3-[2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]-N-ethyl-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)C[C@@H]2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C22H23N3O3/c1-3-23-22(28)17-8-6-9-18(13-17)24-21(27)14-20-19-10-5-4-7-16(19)11-12-25(20)15(2)26/h4-13,20H,3,14H2,1-2H3,(H,23,28)(H,24,27)/t20-/m1/s1