(2S)-1-[[(3R)-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinolin-3-yl]carbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[[(3R)-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinolin-3-yl]carbonyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(3R)-2-benzyloxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[oxo-[(3R)-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(3R)-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carbonyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(3R)-2-carbobenzoxy-3,4-dihydro-1H-isoquinoline-3-carbonyl]proline Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC3=CC=CC=C3CN2C(=O)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@H]2CC3=CC=CC=C3CN2C(=O)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H24N2O5/c26-21(24-12-6-11-19(24)22(27)28)20-13-17-9-4-5-10-18(17)14-25(20)23(29)30-15-16-7-2-1-3-8-16/h1-5,7-10,19-20H,6,11-15H2,(H,27,28)/t19-,20+/m0/s1