2-[[(2S)-2-[methyl(phenylmethoxycarbonyl)amino]-3-phenyl-propanoyl]amino]propanoic acid

Systemtic Name: 2-[[(2S)-2-[methyl(phenylmethoxycarbonyl)amino]-3-phenyl-propanoyl]amino]propanoic acid Openeye Name: 2-[[(2S)-2-[benzyloxycarbonyl(methyl)amino]-3-phenyl-propanoyl]amino]propanoic acid CAS Name: 2-[[(2S)-2-[methyl(phenylmethoxycarbonyl)amino]-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 2-[[(2S)-2-[methyl(phenylmethoxycarbonyl)amino]-3-phenylpropanoyl]amino]propanoic acid Traditional Name: 2-[[(2S)-2-[carbobenzoxy(methyl)amino]-3-phenyl-propanoyl]amino]propionic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-15(20(25)26)22-19(24)18(13-16-9-5-3-6-10-16)23(2)21(27)28-14-17-11-7-4-8-12-17/h3-12,15,18H,13-14H2,1-2H3,(H,22,24)(H,25,26)/t15?,18-/m0/s1