methyl 3-[[(2S)-2-(aminocarbonylamino)-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: methyl 3-[[(2S)-2-(aminocarbonylamino)-3-phenyl-propanoyl]amino]benzoate Openeye Name: methyl 3-[[(2S)-3-phenyl-2-ureido-propanoyl]amino]benzoate CAS Name: 3-[[(2S)-2-(carbamoylamino)-1-oxo-3-phenylpropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(2S)-2-(carbamoylamino)-3-phenylpropanoyl]amino]benzoate Traditional Name: 3-[[(2S)-3-phenyl-2-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(=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)N

InChI

InChI=1S/C18H19N3O4/c1-25-17(23)13-8-5-9-14(11-13)20-16(22)15(21-18(19)24)10-12-6-3-2-4-7-12/h2-9,11,15H,10H2,1H3,(H,20,22)(H3,19,21,24)/t15-/m0/s1