6,7-dimethoxy-4-(phenylmethoxycarbonylamino)-3,4-dihydro-2H-quinoline-1,2-dicarboxylic acid

Systemtic Name: 6,7-dimethoxy-4-(phenylmethoxycarbonylamino)-3,4-dihydro-2H-quinoline-1,2-dicarboxylic acid Openeye Name: 4-(benzyloxycarbonylamino)-6,7-dimethoxy-3,4-dihydro-2H-quinoline-1,2-dicarboxylic acid CAS Name: 6,7-dimethoxy-4-(phenylmethoxycarbonylamino)-3,4-dihydro-2H-quinoline-1,2-dicarboxylic acid IUPAC Name: 6,7-dimethoxy-4-(phenylmethoxycarbonylamino)-3,4-dihydro-2H-quinoline-1,2-dicarboxylic acid Traditional Name: 4-(benzyloxycarbonylamino)-6,7-dimethoxy-3,4-dihydro-2H-quinoline-1,2-dicarboxylic acid Formula: C21H22N2O8 MolecularWeight: 430.40798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(CC(N2C(=O)O)C(=O)O)NC(=O)OCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(CC(N2C(=O)O)C(=O)O)NC(=O)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C21H22N2O8/c1-29-17-8-13-14(22-20(26)31-11-12-6-4-3-5-7-12)9-16(19(24)25)23(21(27)28)15(13)10-18(17)30-2/h3-8,10,14,16H,9,11H2,1-2H3,(H,22,26)(H,24,25)(H,27,28)