methyl 3-[[4-[(aminocarbonylamino)methyl]phenyl]carbonylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: methyl 3-[[4-[(aminocarbonylamino)methyl]phenyl]carbonylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 3-(p-tolyl)-3-[[4-(ureidomethyl)benzoyl]amino]propanoate CAS Name: 3-[[[4-[(carbamoylamino)methyl]phenyl]-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[[4-[(carbamoylamino)methyl]benzoyl]amino]-3-(4-methylphenyl)propanoate Traditional Name: 3-(p-tolyl)-3-[[4-(ureidomethyl)benzoyl]amino]propionic acid methyl ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4/c1-13-3-7-15(8-4-13)17(11-18(24)27-2)23-19(25)16-9-5-14(6-10-16)12-22-20(21)26/h3-10,17H,11-12H2,1-2H3,(H,23,25)(H3,21,22,26)