1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-isoindolin-5-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C2C=C(C=C3)C4=CC5=C(CNC5)C=C4)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C2C=C(C=C3)C4=CC5=C(CNC5)C=C4)C(=O)O

InChI

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