4-[[(3-nitrophenyl)methyl-(3-phenylpropyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(3-nitrophenyl)methyl-(3-phenylpropyl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(3-nitrophenyl)methyl-(3-phenylpropyl)amino]methyl]benzonitrile CAS Name: 4-[[(3-nitrophenyl)methyl-(3-phenylpropyl)amino]methyl]benzonitrile IUPAC Name: 4-[[(3-nitrophenyl)methyl-(3-phenylpropyl)amino]methyl]benzonitrile Traditional Name: 4-[[(3-nitrobenzyl)-(3-phenylpropyl)amino]methyl]benzonitrile Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN(CC2=CC=C(C=C2)C#N)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCN(CC2=CC=C(C=C2)C#N)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O2/c25-17-21-11-13-22(14-12-21)18-26(15-5-9-20-6-2-1-3-7-20)19-23-8-4-10-24(16-23)27(28)29/h1-4,6-8,10-14,16H,5,9,15,18-19H2