methyl 4-[[3-(aminocarbonylamino)-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: methyl 4-[[3-(aminocarbonylamino)-3-phenyl-propanoyl]amino]benzoate Openeye Name: methyl 4-[(3-phenyl-3-ureido-propanoyl)amino]benzoate CAS Name: 4-[[3-(carbamoylamino)-1-oxo-3-phenylpropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(carbamoylamino)-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[(3-phenyl-3-ureido-propanoyl)amino]benzoic acid methyl ester Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O4/c1-25-17(23)13-7-9-14(10-8-13)20-16(22)11-15(21-18(19)24)12-5-3-2-4-6-12/h2-10,15H,11H2,1H3,(H,20,22)(H3,19,21,24)