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

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-nitropyridin-2-yl)piperidin-4-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-nitro-2-pyridyl)-4-piperidyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-nitro-2-pyridinyl)-4-piperidinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-nitropyridin-2-yl)piperidin-4-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-nitro-2-pyridyl)-4-piperidyl]methanone Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)C4=C(C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)C4=C(C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O3/c25-20(23-13-7-15-4-1-2-5-17(15)14-23)16-8-11-22(12-9-16)19-18(24(26)27)6-3-10-21-19/h1-6,10,16H,7-9,11-14H2