2-[(4-methylphenyl)-[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoic acid

Systemtic Name: 2-[(4-methylphenyl)-[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoic acid Openeye Name: 2-(N-[(2S)-2-(benzyloxycarbonylamino)propanoyl]-4-methyl-anilino)acetic acid CAS Name: 2-(4-methyl-N-[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]anilino)acetic acid IUPAC Name: 2-(4-methyl-N-[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]anilino)acetic acid Traditional Name: 2-(N-[(2S)-2-(benzyloxycarbonylamino)propanoyl]-4-methyl-anilino)acetic acid Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)O)C(=O)C(C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)O)C(=O)[C@H](C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O5/c1-14-8-10-17(11-9-14)22(12-18(23)24)19(25)15(2)21-20(26)27-13-16-6-4-3-5-7-16/h3-11,15H,12-13H2,1-2H3,(H,21,26)(H,23,24)/t15-/m0/s1