N-[4-[1-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]ethyl]phenyl]propanamide

Systemtic Name: N-[4-[1-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]ethyl]phenyl]propanamide Openeye Name: N-[4-[1-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]ethyl]phenyl]propanamide CAS Name: N-[4-[1-[[2-(2-acetyl-1H-isoquinolin-1-yl)-1-oxoethyl]amino]ethyl]phenyl]propanamide IUPAC Name: N-[4-[1-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]ethyl]phenyl]propanamide Traditional Name: N-[4-[1-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]ethyl]phenyl]propionamide Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C24H27N3O3/c1-4-23(29)26-20-11-9-18(10-12-20)16(2)25-24(30)15-22-21-8-6-5-7-19(21)13-14-27(22)17(3)28/h5-14,16,22H,4,15H2,1-3H3,(H,25,30)(H,26,29)