N-[(4-dimethylaminophenyl)methyl]-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide Openeye Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide CAS Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide IUPAC Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide Traditional Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-(dimethylamino)benzyl]acetamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2[C@@H]1CC(=O)NCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H25N3O2/c1-16(26)25-13-12-18-6-4-5-7-20(18)21(25)14-22(27)23-15-17-8-10-19(11-9-17)24(2)3/h4-13,21H,14-15H2,1-3H3,(H,23,27)/t21-/m0/s1