4-[1-oxidanylidene-2-(3-piperidin-1-ylpropyl)-3,4-dihydroisoquinolin-6-yl]benzenecarbonitrile

Systemtic Name: 4-[1-oxidanylidene-2-(3-piperidin-1-ylpropyl)-3,4-dihydroisoquinolin-6-yl]benzenecarbonitrile Openeye Name: 4-[1-oxo-2-[3-(1-piperidyl)propyl]-3,4-dihydroisoquinolin-6-yl]benzonitrile CAS Name: 4-[1-oxo-2-[3-(1-piperidinyl)propyl]-3,4-dihydroisoquinolin-6-yl]benzonitrile IUPAC Name: 4-[1-oxo-2-(3-piperidin-1-ylpropyl)-3,4-dihydroisoquinolin-6-yl]benzonitrile Traditional Name: 4-[1-keto-2-(3-piperidinopropyl)-3,4-dihydroisoquinolin-6-yl]benzonitrile Formula: C24H27N3O MolecularWeight: 373.49068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2CCC3=C(C2=O)C=CC(=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCN(CC1)CCCN2CCC3=C(C2=O)C=CC(=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H27N3O/c25-18-19-5-7-20(8-6-19)21-9-10-23-22(17-21)11-16-27(24(23)28)15-4-14-26-12-2-1-3-13-26/h5-10,17H,1-4,11-16H2