N-chloranyl-N-[4-(3-oxidanylidene-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]ethanamide

Systemtic Name: N-chloranyl-N-[4-(3-oxidanylidene-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]ethanamide Openeye Name: N-chloro-N-[4-(4-isopropyl-3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]acetamide CAS Name: N-chloro-N-[4-(3-oxo-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]acetamide IUPAC Name: N-chloro-N-[4-(3-oxo-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]acetamide Traditional Name: N-chloro-N-[4-(4-isopropyl-3-keto-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]acetamide Formula: C20H21ClN2O2 MolecularWeight: 356.84594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)N(C(=O)C)Cl

Isomeric SMILES

CC(C)C1C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)N(C(=O)C)Cl

InChI

InChI=1S/C20H21ClN2O2/c1-12(2)18-16-6-4-5-7-17(16)19(22-20(18)25)14-8-10-15(11-9-14)23(21)13(3)24/h4-12,18-19H,1-3H3,(H,22,25)