N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]-4-nitro-3-oxidanyl-benzamide Openeye Name: 3-hydroxy-N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]-4-nitro-benzamide CAS Name: 3-hydroxy-N-methyl-N-[4-methyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]phenyl]-4-nitrobenzamide IUPAC Name: 3-hydroxy-N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]-4-nitrobenzamide Traditional Name: 3-hydroxy-N-[2-[6-keto-6-(4-methylpiperazino)hexoxy]-4-methyl-phenyl]-N-methyl-4-nitro-benzamide Formula: C26H34N4O6 MolecularWeight: 498.57136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)OCCCCCC(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)OCCCCCC(=O)N3CCN(CC3)C

InChI

InChI=1S/C26H34N4O6/c1-19-8-10-22(28(3)26(33)20-9-11-21(30(34)35)23(31)18-20)24(17-19)36-16-6-4-5-7-25(32)29-14-12-27(2)13-15-29/h8-11,17-18,31H,4-7,12-16H2,1-3H3