2-(phenylcarbonyl)-1-(1-phenylpropyl)isoquinoline-1-carbonitrile

Systemtic Name: 2-(phenylcarbonyl)-1-(1-phenylpropyl)isoquinoline-1-carbonitrile Openeye Name: 2-benzoyl-1-(1-phenylpropyl)isoquinoline-1-carbonitrile CAS Name: 2-benzoyl-1-(1-phenylpropyl)-1-isoquinolinecarbonitrile IUPAC Name: 2-benzoyl-1-(1-phenylpropyl)isoquinoline-1-carbonitrile Traditional Name: 2-benzoyl-1-(1-phenylpropyl)isoquinoline-1-carbonitrile Formula: C26H22N2O MolecularWeight: 378.46568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C2(C3=CC=CC=C3C=CN2C(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

CCC(C1=CC=CC=C1)C2(C3=CC=CC=C3C=CN2C(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C26H22N2O/c1-2-23(20-11-5-3-6-12-20)26(19-27)24-16-10-9-13-21(24)17-18-28(26)25(29)22-14-7-4-8-15-22/h3-18,23H,2H2,1H3