[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl] quinoline-2-carboxylate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl] quinoline-2-carboxylate Openeye Name: [2-(indan-5-ylamino)-2-oxo-ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] quinoline-2-carboxylate Traditional Name: quinaldic acid [2-(indan-5-ylamino)-2-keto-ethyl] ester Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)COC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)COC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H18N2O3/c24-20(22-17-10-8-14-5-3-6-16(14)12-17)13-26-21(25)19-11-9-15-4-1-2-7-18(15)23-19/h1-2,4,7-12H,3,5-6,13H2,(H,22,24)