(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(5-nitro-2-piperidin-1-yl-phenyl)methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(5-nitro-2-piperidin-1-yl-phenyl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[5-nitro-2-(1-piperidyl)phenyl]methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[5-nitro-2-(1-piperidinyl)phenyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(5-nitro-2-piperidin-1-ylphenyl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(5-nitro-2-piperidino-phenyl)methanone Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCC4)OC

InChI

InChI=1S/C23H27N3O5/c1-30-21-12-16-8-11-25(15-17(16)13-22(21)31-2)23(27)19-14-18(26(28)29)6-7-20(19)24-9-4-3-5-10-24/h6-7,12-14H,3-5,8-11,15H2,1-2H3