4-[4-(2-methylphenyl)piperazin-1-yl]-3-nitro-benzaldehyde

Systemtic Name: 4-[4-(2-methylphenyl)piperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 3-nitro-4-[4-(o-tolyl)piperazin-1-yl]benzaldehyde CAS Name: 4-[4-(2-methylphenyl)-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-(2-methylphenyl)piperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 3-nitro-4-[4-(o-tolyl)piperazino]benzaldehyde Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3/c1-14-4-2-3-5-16(14)19-8-10-20(11-9-19)17-7-6-15(13-22)12-18(17)21(23)24/h2-7,12-13H,8-11H2,1H3