1-cyclopropyl-8-methoxy-4-oxidanylidene-7-(4-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methoxy-4-oxidanylidene-7-(4-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-methoxy-4-oxo-7-(4-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophen-2-yl)quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methoxy-4-oxo-7-[4-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methoxy-4-oxo-7-(4-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-8-methoxy-7-(4-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophen-2-yl)quinoline-3-carboxylic acid Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(S4)CCCC5N6C=CC=C6

Isomeric SMILES

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(S4)CCCC5N6C=CC=C6

InChI

InChI=1S/C26H24N2O4S/c1-32-25-16(22-13-18-20(27-11-2-3-12-27)5-4-6-21(18)33-22)9-10-17-23(25)28(15-7-8-15)14-19(24(17)29)26(30)31/h2-3,9-15,20H,4-8H2,1H3,(H,30,31)