2-[[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 2-[[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]methyl]benzenecarbonitrile Openeye Name: 2-[[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]methyl]benzonitrile CAS Name: 2-[[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl-[2-(1-pyrrolidinyl)ethyl]amino]methyl]benzonitrile IUPAC Name: 2-[[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]methyl]benzonitrile Traditional Name: 2-[[(1-m-anisylpyrrol-2-yl)methyl-(2-pyrrolidinoethyl)amino]methyl]benzonitrile Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=CC=C2CN(CCN3CCCC3)CC4=CC=CC=C4C#N

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=CC=C2CN(CCN3CCCC3)CC4=CC=CC=C4C#N

InChI

InChI=1S/C27H32N4O/c1-32-27-12-6-8-23(18-27)20-31-15-7-11-26(31)22-30(17-16-29-13-4-5-14-29)21-25-10-3-2-9-24(25)19-28/h2-3,6-12,15,18H,4-5,13-14,16-17,20-22H2,1H3