(3,5-dinitrophenyl)-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)piperidin-1-yl]methanone

Systemtic Name: (3,5-dinitrophenyl)-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)piperidin-1-yl]methanone Openeye Name: (3,5-dinitrophenyl)-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-piperidyl]methanone CAS Name: (3,5-dinitrophenyl)-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-piperidinyl]methanone IUPAC Name: (3,5-dinitrophenyl)-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)piperidin-1-yl]methanone Traditional Name: (3,5-dinitrophenyl)-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)piperidino]methanone Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC=CC=C2C1C3CCN(CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CCC2=CC=CC=C2C1C3CCN(CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c1-23-9-6-15-4-2-3-5-20(15)21(23)16-7-10-24(11-8-16)22(27)17-12-18(25(28)29)14-19(13-17)26(30)31/h2-5,12-14,16,21H,6-11H2,1H3