Allyl[3-(2-nitrobenzenesulfonamido)propyl]carbamate

• CAS: 312283-45-7
• Catalog Number: ACM312283457
• Category: Other Products
• Molecular Weight: 343.36g/mol
• Molecular Formula: C13H17N3O6S
• Synonyms: ALLYL [3-(2-NITROBENZENESULFONAMIDO)PROPYL]CARBAMATE;[3-(2-NITROBENZENESULFONAMIDO)PROPYL]CARBAMIC ACID ALLYL ESTER
• IUPAC Name: prop-2-enyl N-[3-[(2-nitrophenyl)sulfonylamino]propyl]carbamate
• Canonical SMILES: C=CCOC(=O)NCCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]
• InChI: InChI=1S/C13H17N3O6S/c1-2-10-22-13(17)14-8-5-9-15-23(20,21)12-7-4-3-6-11(12)16(18)19/h2-4,6-7,15H,1,5,8-10H2,(H,14,17)
• InChI Key: INKIDQWOEVNHHA-UHFFFAOYSA-N
• Complexity: 511
• Covalently-Bonded Unit Count: 1
• Exact Mass: 343.083806g/mol
• Formal Charge: 0
• H-Bond Acceptor: 7
• H-Bond Donor: 2
• Heavy Atom Count: 23
• Monoisotopic Mass: 343.083806g/mol
• Rotatable Bond Count: 9
• XLogP3: 1.4