2-chloranyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]-N-methyl-ethanamide

Systemtic Name: 2-chloranyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]-N-methyl-ethanamide Openeye Name: 2-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]-N-methyl-acetamide CAS Name: 2-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrophenyl]-N-methylacetamide IUPAC Name: 2-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrophenyl]-N-methylacetamide Traditional Name: 2-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]-N-methyl-acetamide Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=CC(=C1)[N+](=O)[O-])N2CCC3=CC=CC=C3C2)C(=O)CCl

Isomeric SMILES

CN(C1=C(C=CC(=C1)[N+](=O)[O-])N2CCC3=CC=CC=C3C2)C(=O)CCl

InChI

InChI=1S/C18H18ClN3O3/c1-20(18(23)11-19)17-10-15(22(24)25)6-7-16(17)21-9-8-13-4-2-3-5-14(13)12-21/h2-7,10H,8-9,11-12H2,1H3