methyl 2-[[3-(aminocarbonylamino)-3-(3-methylphenyl)propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[3-(aminocarbonylamino)-3-(3-methylphenyl)propanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[3-(m-tolyl)-3-ureido-propanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[3-(carbamoylamino)-3-(3-methylphenyl)-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[3-(carbamoylamino)-3-(3-methylphenyl)propanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[3-(m-tolyl)-3-ureido-propanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)NC(CC2=CC=CC=C2)C(=O)OC)NC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)NC(CC2=CC=CC=C2)C(=O)OC)NC(=O)N

InChI

InChI=1S/C21H25N3O4/c1-14-7-6-10-16(11-14)17(24-21(22)27)13-19(25)23-18(20(26)28-2)12-15-8-4-3-5-9-15/h3-11,17-18H,12-13H2,1-2H3,(H,23,25)(H3,22,24,27)