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

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[[2-(3-methyl-1-oxo-2-isoquinolyl)acetyl]amino]acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[[2-(3-methyl-1-oxo-2-isoquinolinyl)-1-oxoethyl]amino]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[[2-(3-methyl-1-oxoisoquinolin-2-yl)acetyl]amino]acetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[[2-(1-keto-3-methyl-2-isoquinolyl)acetyl]amino]acetamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H20ClN3O4/c1-13-9-14-5-3-4-6-16(14)21(28)25(13)12-20(27)23-11-19(26)24-15-7-8-18(29-2)17(22)10-15/h3-10H,11-12H2,1-2H3,(H,23,27)(H,24,26)