(4-tert-butylphenyl)methyl-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-methyl-azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl]-methyl-ammonium Formula: C20H27N4O+ MolecularWeight: 339.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C)C#N

InChI

InChI=1S/C20H26N4O/c1-14-15(2)22-24(19(25)18(14)11-21)13-23(6)12-16-7-9-17(10-8-16)20(3,4)5/h7-10H,12-13H2,1-6H3/p+1