3-methyl-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-4-nitro-benzamide Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)N4CCN(CC4)C

InChI

InChI=1S/C23H25N5O3/c1-15-13-22(27-10-8-26(3)9-11-27)25-20-6-5-18(14-19(15)20)24-23(29)17-4-7-21(28(30)31)16(2)12-17/h4-7,12-14H,8-11H2,1-3H3,(H,24,29)