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

Systemtic Name: butyl 4-[[2-(aminocarbonylamino)-3-phenyl-propanoyl]amino]benzoate Openeye Name: butyl 4-[(3-phenyl-2-ureido-propanoyl)amino]benzoate CAS Name: 4-[[2-(carbamoylamino)-1-oxo-3-phenylpropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(carbamoylamino)-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[(3-phenyl-2-ureido-propanoyl)amino]benzoic acid butyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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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)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)N

InChI

InChI=1S/C21H25N3O4/c1-2-3-13-28-20(26)16-9-11-17(12-10-16)23-19(25)18(24-21(22)27)14-15-7-5-4-6-8-15/h4-12,18H,2-3,13-14H2,1H3,(H,23,25)(H3,22,24,27)