2-[4-(phenylmethoxycarbonylamino)cyclohexyl]carbonyl-1,3-dihydroisoindole-5-carboxylic acid

Systemtic Name: 2-[4-(phenylmethoxycarbonylamino)cyclohexyl]carbonyl-1,3-dihydroisoindole-5-carboxylic acid Openeye Name: 2-[4-(benzyloxycarbonylamino)cyclohexanecarbonyl]isoindoline-5-carboxylic acid CAS Name: 2-[oxo-[4-(phenylmethoxycarbonylamino)cyclohexyl]methyl]-1,3-dihydroisoindole-5-carboxylic acid IUPAC Name: 2-[4-(phenylmethoxycarbonylamino)cyclohexanecarbonyl]-1,3-dihydroisoindole-5-carboxylic acid Traditional Name: 2-[4-(benzyloxycarbonylamino)cyclohexanecarbonyl]isoindoline-5-carboxylic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)N2CC3=C(C2)C=C(C=C3)C(=O)O)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1C(=O)N2CC3=C(C2)C=C(C=C3)C(=O)O)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O5/c27-22(26-13-19-7-6-18(23(28)29)12-20(19)14-26)17-8-10-21(11-9-17)25-24(30)31-15-16-4-2-1-3-5-16/h1-7,12,17,21H,8-11,13-15H2,(H,25,30)(H,28,29)