N-[(4-acetyloxy-3-methyl-phenyl)sulfonyl-butyl-amino]-N-(2-oxidanylpropyl)carbamate

Systemtic Name: N-[(4-acetyloxy-3-methyl-phenyl)sulfonyl-butyl-amino]-N-(2-oxidanylpropyl)carbamate Openeye Name: N-[(4-acetoxy-3-methyl-phenyl)sulfonyl-butyl-amino]-N-(2-hydroxypropyl)carbamate CAS Name: N-[(4-acetyloxy-3-methylphenyl)sulfonyl-butylamino]-N-(2-hydroxypropyl)carbamate IUPAC Name: N-[(4-acetyloxy-3-methylphenyl)sulfonyl-butylamino]-N-(2-hydroxypropyl)carbamate Traditional Name: N-[(4-acetoxy-3-methyl-phenyl)sulfonyl-butyl-amino]-N-(2-hydroxypropyl)carbamate Formula: C17H25N2O7S- MolecularWeight: 401.4546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(N(CC(C)O)C(=O)[O-])S(=O)(=O)C1=CC(=C(C=C1)OC(=O)C)C

Isomeric SMILES

CCCCN(N(CC(C)O)C(=O)[O-])S(=O)(=O)C1=CC(=C(C=C1)OC(=O)C)C

InChI

InChI=1S/C17H26N2O7S/c1-5-6-9-19(18(17(22)23)11-13(3)20)27(24,25)15-7-8-16(12(2)10-15)26-14(4)21/h7-8,10,13,20H,5-6,9,11H2,1-4H3,(H,22,23)/p-1