propan-2-yl N-(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)carbamate

Systemtic Name: propan-2-yl N-(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)carbamate Openeye Name: isopropyl N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)carbamate CAS Name: N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-(7-chloro-1-oxo-2H-isoquinolin-6-yl)carbamate Traditional Name: N-(7-chloro-1-keto-2H-isoquinolin-6-yl)carbamic acid isopropyl ester Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=C(C=C2C(=C1)C=CNC2=O)Cl

Isomeric SMILES

CC(C)OC(=O)NC1=C(C=C2C(=C1)C=CNC2=O)Cl

InChI

InChI=1S/C13H13ClN2O3/c1-7(2)19-13(18)16-11-5-8-3-4-15-12(17)9(8)6-10(11)14/h3-7H,1-2H3,(H,15,17)(H,16,18)