butyl 4-[[2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: butyl 4-[[2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: butyl 4-[[2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 4-[[2-[(4-ethoxy-3-methylphenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(4-ethoxy-3-methylphenyl)sulfonylamino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[[2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoic acid butyl ester Formula: C29H34N2O6S MolecularWeight: 538.65506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)OCC)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)OCC)C

InChI

InChI=1S/C29H34N2O6S/c1-4-6-18-37-29(33)23-12-14-24(15-13-23)30-28(32)26(20-22-10-8-7-9-11-22)31-38(34,35)25-16-17-27(36-5-2)21(3)19-25/h7-17,19,26,31H,4-6,18,20H2,1-3H3,(H,30,32)