2-[2-[(3-nitropyridin-2-yl)-(3-piperidin-1-ylpropyl)amino]phenyl]benzaldehyde

Systemtic Name: 2-[2-[(3-nitropyridin-2-yl)-(3-piperidin-1-ylpropyl)amino]phenyl]benzaldehyde Openeye Name: 2-[2-[(3-nitro-2-pyridyl)-[3-(1-piperidyl)propyl]amino]phenyl]benzaldehyde CAS Name: 2-[2-[(3-nitro-2-pyridinyl)-[3-(1-piperidinyl)propyl]amino]phenyl]benzaldehyde IUPAC Name: 2-[2-[(3-nitropyridin-2-yl)-(3-piperidin-1-ylpropyl)amino]phenyl]benzaldehyde Traditional Name: 2-[2-[(3-nitro-2-pyridyl)-(3-piperidinopropyl)amino]phenyl]benzaldehyde Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN(C2=CC=CC=C2C3=CC=CC=C3C=O)C4=C(C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CCCN(C2=CC=CC=C2C3=CC=CC=C3C=O)C4=C(C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C26H28N4O3/c31-20-21-10-2-3-11-22(21)23-12-4-5-13-24(23)29(19-9-18-28-16-6-1-7-17-28)26-25(30(32)33)14-8-15-27-26/h2-5,8,10-15,20H,1,6-7,9,16-19H2