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

Systemtic Name: ethyl 4-[[2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C27H30N2O6S MolecularWeight: 510.6019

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)OCC)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)OCC)C

InChI

InChI=1S/C27H30N2O6S/c1-4-34-25-16-15-23(17-19(25)3)36(32,33)29-24(18-20-9-7-6-8-10-20)26(30)28-22-13-11-21(12-14-22)27(31)35-5-2/h6-17,24,29H,4-5,18H2,1-3H3,(H,28,30)