N-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-1-(4-nitrophenyl)methanimine

Systemtic Name: N-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-1-(4-nitrophenyl)methanimine Openeye Name: N-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-1-(4-nitrophenyl)methanimine CAS Name: N-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-1-(4-nitrophenyl)methanimine IUPAC Name: N-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-1-(4-nitrophenyl)methanimine Traditional Name: (6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl-(4-nitrobenzylidene)amine Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)CN=CC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)CN=CC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21N3O4/c1-25-18-9-14-7-8-21-17(16(14)10-19(18)26-2)12-20-11-13-3-5-15(6-4-13)22(23)24/h3-6,9-11,17,21H,7-8,12H2,1-2H3