6-azanyl-1-(4-methoxyphenyl)-8-methyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-azanyl-1-(4-methoxyphenyl)-8-methyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-amino-1-(4-methoxyphenyl)-8-methyl-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-amino-1-(4-methoxyphenyl)-8-methyl-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-amino-1-(4-methoxyphenyl)-8-methyl-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-amino-4-keto-1-(4-methoxyphenyl)-8-methyl-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCN(CC3)C)N)C(=O)C(=CN2C4=CC=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCN(CC3)C)N)C(=O)C(=CN2C4=CC=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C23H26N4O4/c1-14-20-17(12-19(24)21(14)26-10-8-25(2)9-11-26)22(28)18(23(29)30)13-27(20)15-4-6-16(31-3)7-5-15/h4-7,12-13H,8-11,24H2,1-3H3,(H,29,30)