methyl 3-[2-[(5-azanyl-2-chloranyl-phenyl)carbonylamino]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-[(5-azanyl-2-chloranyl-phenyl)carbonylamino]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-[(5-amino-2-chloro-benzoyl)amino]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-[[(5-amino-2-chlorophenyl)-oxomethyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-[(5-amino-2-chlorobenzoyl)amino]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[(5-amino-2-chloro-benzoyl)amino]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=C(C=CC(=C2)N)Cl

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=C(C=CC(=C2)N)Cl

InChI

InChI=1S/C19H20ClN3O4/c1-27-18(25)10-16(12-5-3-2-4-6-12)23-17(24)11-22-19(26)14-9-13(21)7-8-15(14)20/h2-9,16H,10-11,21H2,1H3,(H,22,26)(H,23,24)