2-[[5-oxidanylidene-1-[[1-(3-phenylpropyl)piperidin-4-yl]methyl]-2H-pyrrol-3-yl]amino]benzenecarbonitrile

Systemtic Name: 2-[[5-oxidanylidene-1-[[1-(3-phenylpropyl)piperidin-4-yl]methyl]-2H-pyrrol-3-yl]amino]benzenecarbonitrile Openeye Name: 2-[[5-oxo-1-[[1-(3-phenylpropyl)-4-piperidyl]methyl]-2H-pyrrol-3-yl]amino]benzonitrile CAS Name: 2-[[5-oxo-1-[[1-(3-phenylpropyl)-4-piperidinyl]methyl]-2H-pyrrol-3-yl]amino]benzonitrile IUPAC Name: 2-[[5-oxo-1-[[1-(3-phenylpropyl)piperidin-4-yl]methyl]-2H-pyrrol-3-yl]amino]benzonitrile Traditional Name: 2-[[5-keto-1-[[1-(3-phenylpropyl)-4-piperidyl]methyl]-3-pyrrolin-3-yl]amino]benzonitrile Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC(=CC2=O)NC3=CC=CC=C3C#N)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CN2CC(=CC2=O)NC3=CC=CC=C3C#N)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H30N4O/c27-18-23-10-4-5-11-25(23)28-24-17-26(31)30(20-24)19-22-12-15-29(16-13-22)14-6-9-21-7-2-1-3-8-21/h1-5,7-8,10-11,17,22,28H,6,9,12-16,19-20H2