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

Systemtic Name: 4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 3-nitro-4-[4-(o-tolylmethyl)piperazin-1-yl]benzaldehyde CAS Name: 4-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 4-[4-(2-methylbenzyl)piperazino]-3-nitro-benzaldehyde Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3/c1-15-4-2-3-5-17(15)13-20-8-10-21(11-9-20)18-7-6-16(14-23)12-19(18)22(24)25/h2-7,12,14H,8-11,13H2,1H3