7-(4-azanyl-4-methyl-6,7-dihydro-5H-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(4-azanyl-4-methyl-6,7-dihydro-5H-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-amino-4-methyl-6,7-dihydro-5H-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-amino-4-methyl-6,7-dihydro-5H-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-amino-4-methyl-6,7-dihydro-5H-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-amino-4-methyl-6,7-dihydro-5H-benzothiophen-2-yl)-1-cyclopropyl-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2=C1C=C(S2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC)N

Isomeric SMILES

CC1(CCCC2=C1C=C(S2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC)N

InChI

InChI=1S/C23H24N2O4S/c1-23(24)9-3-4-17-16(23)10-18(30-17)13-7-8-14-19(21(13)29-2)25(12-5-6-12)11-15(20(14)26)22(27)28/h7-8,10-12H,3-6,9,24H2,1-2H3,(H,27,28)