N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]ethanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]ethanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-(3-methyl-1-oxo-2-isoquinolyl)acetyl]amino]acetamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-(3-methyl-1-oxo-2-isoquinolinyl)-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-(3-methyl-1-oxoisoquinolin-2-yl)acetyl]amino]acetamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-(1-keto-3-methyl-2-isoquinolyl)acetyl]amino]acetamide Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CNC(=O)CN2C(=CC3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CNC(=O)CN2C(=CC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C22H22ClN3O4/c1-13-8-18(19(30-3)10-17(13)23)25-20(27)11-24-21(28)12-26-14(2)9-15-6-4-5-7-16(15)22(26)29/h4-10H,11-12H2,1-3H3,(H,24,28)(H,25,27)