[6-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-nitrofuran-2-yl)methanone chloride

Systemtic Name: [6-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-nitrofuran-2-yl)methanone chloride Openeye Name: [6-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-nitro-2-furyl)methanone chloride CAS Name: [6-(4-methyl-1-piperazinyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-nitro-2-furanyl)methanone chloride IUPAC Name: [6-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-nitrofuran-2-yl)methanone chloride Traditional Name: [6-(4-methylpiperazino)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-nitro-2-furyl)methanone chloride Formula: C19H22ClN4O4- MolecularWeight: 405.85538

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(CN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-])C=C2.[Cl-]

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(CN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-])C=C2.[Cl-]

InChI

InChI=1S/C19H22N4O4.ClH/c1-20-8-10-21(11-9-20)16-3-2-15-13-22(7-6-14(15)12-16)19(24)17-4-5-18(27-17)23(25)26;/h2-5,12H,6-11,13H2,1H3;1H/p-1