ethyl 4-[4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoylamino]benzoate

Systemtic Name: ethyl 4-[4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoylamino]benzoate Openeye Name: ethyl 4-[4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoylamino]benzoate CAS Name: 4-[[4-[(4-acetylphenyl)sulfonyl-methylamino]-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4-acetylphenyl)sulfonyl-methylamino]butanoylamino]benzoate Traditional Name: 4-[4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoylamino]benzoic acid ethyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C22H26N2O6S/c1-4-30-22(27)18-7-11-19(12-8-18)23-21(26)6-5-15-24(3)31(28,29)20-13-9-17(10-14-20)16(2)25/h7-14H,4-6,15H2,1-3H3,(H,23,26)