N-[3-[(3-cyanophenyl)methoxy]phenyl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-[(3-cyanophenyl)methoxy]phenyl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-[(3-cyanophenyl)methoxy]phenyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-[(3-cyanophenyl)methoxy]phenyl]acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(3-cyanobenzyl)oxyphenyl]acetamide Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC(=CC=C3)OCC4=CC=CC(=C4)C#N

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC(=CC=C3)OCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H23N3O3/c1-19(31)30-13-12-22-8-2-3-11-25(22)26(30)16-27(32)29-23-9-5-10-24(15-23)33-18-21-7-4-6-20(14-21)17-28/h2-15,26H,16,18H2,1H3,(H,29,32)