butyl 4-[[2-[(2-chloranyl-2-phenyl-ethanoyl)amino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: butyl 4-[[2-[(2-chloranyl-2-phenyl-ethanoyl)amino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: butyl 4-[[2-[(2-chloro-2-phenyl-acetyl)amino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 4-[[2-[(2-chloro-1-oxo-2-phenylethyl)amino]-1-oxo-3-phenylpropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(2-chloro-2-phenylacetyl)amino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[[2-[(2-chloro-2-phenyl-acetyl)amino]-3-phenyl-propanoyl]amino]benzoic acid butyl ester Formula: C28H29ClN2O4 MolecularWeight: 492.99386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29ClN2O4/c1-2-3-18-35-28(34)22-14-16-23(17-15-22)30-26(32)24(19-20-10-6-4-7-11-20)31-27(33)25(29)21-12-8-5-9-13-21/h4-17,24-25H,2-3,18-19H2,1H3,(H,30,32)(H,31,33)