N-(2-chloranyl-5-nitro-phenyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propionamide Formula: C20H22ClN3O5 MolecularWeight: 419.85878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C20H22ClN3O5/c1-12(20(25)22-17-10-15(24(26)27)4-5-16(17)21)23-7-6-13-8-18(28-2)19(29-3)9-14(13)11-23/h4-5,8-10,12H,6-7,11H2,1-3H3,(H,22,25)