2-[[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 2-[[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]methyl]benzenecarbonitrile Openeye Name: 2-[[benzyl-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]amino]methyl]benzonitrile CAS Name: 2-[[[1-[(4-methylphenyl)methyl]-2-pyrrolyl]methyl-(phenylmethyl)amino]methyl]benzonitrile IUPAC Name: 2-[[benzyl-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]methyl]benzonitrile Traditional Name: 2-[[benzyl-[[1-(4-methylbenzyl)pyrrol-2-yl]methyl]amino]methyl]benzonitrile Formula: C28H27N3 MolecularWeight: 405.53408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CC=C2CN(CC3=CC=CC=C3)CC4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CC=C2CN(CC3=CC=CC=C3)CC4=CC=CC=C4C#N

InChI

InChI=1S/C28H27N3/c1-23-13-15-25(16-14-23)20-31-17-7-12-28(31)22-30(19-24-8-3-2-4-9-24)21-27-11-6-5-10-26(27)18-29/h2-17H,19-22H2,1H3