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

Systemtic Name: [[(2S)-2-(2-azanylethanoylamino)-3-phenyl-propanoyl]amino] benzoate Openeye Name: [[(2S)-2-[(2-aminoacetyl)amino]-3-phenyl-propanoyl]amino] benzoate CAS Name: benzoic acid [[(2S)-2-[(2-amino-1-oxoethyl)amino]-1-oxo-3-phenylpropyl]amino] ester IUPAC Name: [[(2S)-2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino] benzoate Traditional Name: benzoic acid [[(2S)-2-(glycylamino)-3-phenyl-propanoyl]amino] ester Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NOC(=O)C2=CC=CC=C2)NC(=O)CN

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NOC(=O)C2=CC=CC=C2)NC(=O)CN

InChI

InChI=1S/C18H19N3O4/c19-12-16(22)20-15(11-13-7-3-1-4-8-13)17(23)21-25-18(24)14-9-5-2-6-10-14/h1-10,15H,11-12,19H2,(H,20,22)(H,21,23)/t15-/m0/s1