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

Systemtic Name: [4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)piperidin-1-yl]-(4-nitrophenyl)methanone Openeye Name: [4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-piperidyl]-(4-nitrophenyl)methanone CAS Name: [4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-piperidinyl]-(4-nitrophenyl)methanone IUPAC Name: [4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)piperidin-1-yl]-(4-nitrophenyl)methanone Traditional Name: [4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)piperidino]-(4-nitrophenyl)methanone Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O3/c1-23-13-10-16-4-2-3-5-20(16)21(23)17-11-14-24(15-12-17)22(26)18-6-8-19(9-7-18)25(27)28/h2-9,17,21H,10-15H2,1H3