[(3R)-1-(1-methyl-6-oxidanylidene-pyridazin-4-yl)pyrrolidin-3-yl]methyl-(4-phenylcyclohexyl)azanium

Systemtic Name: [(3R)-1-(1-methyl-6-oxidanylidene-pyridazin-4-yl)pyrrolidin-3-yl]methyl-(4-phenylcyclohexyl)azanium Openeye Name: [(3R)-1-(1-methyl-6-oxo-pyridazin-4-yl)pyrrolidin-3-yl]methyl-(4-phenylcyclohexyl)ammonium CAS Name: [(3R)-1-(1-methyl-6-oxo-4-pyridazinyl)-3-pyrrolidinyl]methyl-(4-phenylcyclohexyl)ammonium IUPAC Name: [(3R)-1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl-(4-phenylcyclohexyl)azanium Traditional Name: [(3R)-1-(6-keto-1-methyl-pyridazin-4-yl)pyrrolidin-3-yl]methyl-(4-phenylcyclohexyl)ammonium Formula: C22H31N4O+ MolecularWeight: 367.50774

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CCC(C2)C[NH2+]C3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CC[C@@H](C2)C[NH2+]C3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H30N4O/c1-25-22(27)13-21(15-24-25)26-12-11-17(16-26)14-23-20-9-7-19(8-10-20)18-5-3-2-4-6-18/h2-6,13,15,17,19-20,23H,7-12,14,16H2,1H3/p+1/t17-,19?,20?/m1/s1