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

Systemtic Name: 7-(7-azanyl-4,4-dimethyl-6,7-dihydro-5H-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(7-amino-4,4-dimethyl-6,7-dihydro-5H-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(7-amino-4,4-dimethyl-6,7-dihydro-5H-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(7-amino-4,4-dimethyl-6,7-dihydro-5H-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(7-amino-4,4-dimethyl-6,7-dihydro-5H-benzothiophen-2-yl)-1-cyclopropyl-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=C(S2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC)N)C

Isomeric SMILES

CC1(CCC(C2=C1C=C(S2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC)N)C

InChI

InChI=1S/C24H26N2O4S/c1-24(2)9-8-17(25)22-16(24)10-18(31-22)13-6-7-14-19(21(13)30-3)26(12-4-5-12)11-15(20(14)27)23(28)29/h6-7,10-12,17H,4-5,8-9,25H2,1-3H3,(H,28,29)