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

Systemtic Name: 2-[[cyclohexyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]methyl]benzenecarbonitrile Openeye Name: 2-[[(1-benzylpyrrol-2-yl)methyl-cyclohexyl-amino]methyl]benzonitrile CAS Name: 2-[[cyclohexyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]methyl]benzonitrile IUPAC Name: 2-[[(1-benzylpyrrol-2-yl)methyl-cyclohexylamino]methyl]benzonitrile Traditional Name: 2-[[(1-benzylpyrrol-2-yl)methyl-cyclohexyl-amino]methyl]benzonitrile Formula: C26H29N3 MolecularWeight: 383.52856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=CC=C2C#N)CC3=CC=CN3CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=CC=C2C#N)CC3=CC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3/c27-18-23-12-7-8-13-24(23)20-29(25-14-5-2-6-15-25)21-26-16-9-17-28(26)19-22-10-3-1-4-11-22/h1,3-4,7-13,16-17,25H,2,5-6,14-15,19-21H2