2-methyl-6-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-methyl-6-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-methyl-6-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-methyl-6-[oxo-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-piperidinyl]methyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-methyl-6-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-methyl-6-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCC(=N1)C(=O)N2CCCC(C2)[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C(=O)CCC(=N1)C(=O)N2CCC[C@@H](C2)[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H26N4O2/c1-22-19(25)9-8-18(21-22)20(26)24-11-4-7-17(14-24)23-12-10-15-5-2-3-6-16(15)13-23/h2-3,5-6,17H,4,7-14H2,1H3/p+1/t17-/m0/s1