2-[2-[1-(4-methylpiperazin-1-yl)propyl-(3-nitropyridin-2-yl)amino]phenyl]benzaldehyde

Systemtic Name: 2-[2-[1-(4-methylpiperazin-1-yl)propyl-(3-nitropyridin-2-yl)amino]phenyl]benzaldehyde Openeye Name: 2-[2-[1-(4-methylpiperazin-1-yl)propyl-(3-nitro-2-pyridyl)amino]phenyl]benzaldehyde CAS Name: 2-[2-[1-(4-methyl-1-piperazinyl)propyl-(3-nitro-2-pyridinyl)amino]phenyl]benzaldehyde IUPAC Name: 2-[2-[1-(4-methylpiperazin-1-yl)propyl-(3-nitropyridin-2-yl)amino]phenyl]benzaldehyde Traditional Name: 2-[2-[1-(4-methylpiperazino)propyl-(3-nitro-2-pyridyl)amino]phenyl]benzaldehyde Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCN(CC1)C)N(C2=CC=CC=C2C3=CC=CC=C3C=O)C4=C(C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CCC(N1CCN(CC1)C)N(C2=CC=CC=C2C3=CC=CC=C3C=O)C4=C(C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C26H29N5O3/c1-3-25(29-17-15-28(2)16-18-29)30(26-24(31(33)34)13-8-14-27-26)23-12-7-6-11-22(23)21-10-5-4-9-20(21)19-32/h4-14,19,25H,3,15-18H2,1-2H3