3-(4-cyanophenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]propanamide

Systemtic Name: 3-(4-cyanophenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]propanamide Openeye Name: 3-(4-cyanophenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]propanamide CAS Name: 3-(4-cyanophenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]propanamide IUPAC Name: 3-(4-cyanophenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]propanamide Traditional Name: 3-(4-cyanophenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]propionamide Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CCC1=CC=C(C=C1)C#N)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCC(CNC(=O)CCC1=CC=C(C=C1)C#N)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C23H27N3O/c1-2-22(26-14-13-20-5-3-4-6-21(20)17-26)16-25-23(27)12-11-18-7-9-19(15-24)10-8-18/h3-10,22H,2,11-14,16-17H2,1H3,(H,25,27)