2-chloranyl-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-nitro-aniline

Systemtic Name: 2-chloranyl-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-nitro-aniline Openeye Name: 2-chloro-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-nitro-aniline CAS Name: 2-chloro-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-nitroaniline IUPAC Name: 2-chloro-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-nitroaniline Traditional Name: (2-chloro-4-nitro-phenyl)-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]amine Formula: C19H22ClN3O4 MolecularWeight: 391.84868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C19H22ClN3O4/c1-26-18-9-13-5-7-22(12-14(13)10-19(18)27-2)8-6-21-17-4-3-15(23(24)25)11-16(17)20/h3-4,9-11,21H,5-8,12H2,1-2H3