N-[(7-azanyl-2,2-dimethyl-heptyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-oxidanyl-1-phenyl-butan-2-yl)carbamate

Systemtic Name: N-[(7-azanyl-2,2-dimethyl-heptyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-oxidanyl-1-phenyl-butan-2-yl)carbamate Openeye Name: N-[(7-amino-2,2-dimethyl-heptyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(1-benzyl-2-hydroxy-propyl)carbamate CAS Name: N-[(7-amino-2,2-dimethylheptyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-hydroxy-1-phenylbutan-2-yl)carbamate IUPAC Name: N-[(7-amino-2,2-dimethylheptyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-hydroxy-1-phenylbutan-2-yl)carbamate Traditional Name: N-[(7-amino-2,2-dimethyl-heptyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(1-benzyl-2-hydroxy-propyl)carbamate Formula: C27H38N3O7S- MolecularWeight: 548.67152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=CC=C1)N(C(=O)[O-])N(CC(C)(C)CCCCCN)S(=O)(=O)C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC(C(CC1=CC=CC=C1)N(C(=O)[O-])N(CC(C)(C)CCCCCN)S(=O)(=O)C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C27H39N3O7S/c1-20(31)23(16-21-10-6-4-7-11-21)30(26(32)33)29(18-27(2,3)14-8-5-9-15-28)38(34,35)22-12-13-24-25(17-22)37-19-36-24/h4,6-7,10-13,17,20,23,31H,5,8-9,14-16,18-19,28H2,1-3H3,(H,32,33)/p-1