3-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]-N,4-dimethyl-benzamide

Systemtic Name: 3-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]-N,4-dimethyl-benzamide Openeye Name: 3-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]-N,4-dimethyl-benzamide CAS Name: 3-[[2-(2-acetyl-1H-isoquinolin-1-yl)-1-oxoethyl]amino]-N,4-dimethylbenzamide IUPAC Name: 3-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]-N,4-dimethylbenzamide Traditional Name: 3-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]-N,4-dimethyl-benzamide Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C22H23N3O3/c1-14-8-9-17(22(28)23-3)12-19(14)24-21(27)13-20-18-7-5-4-6-16(18)10-11-25(20)15(2)26/h4-12,20H,13H2,1-3H3,(H,23,28)(H,24,27)