[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl]-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl]-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-azanium Openeye Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxo-ethyl]-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-ammonium CAS Name: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylammonium IUPAC Name: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylazanium Traditional Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-keto-ethyl]-(4,5-dimethoxy-2-methyl-benzyl)-methyl-ammonium Formula: C21H32N3O3+ MolecularWeight: 374.49708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)CC(=O)N(C)C2(CCCCC2)C#N)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)CC(=O)N(C)C2(CCCCC2)C#N)OC)OC

InChI

InChI=1S/C21H31N3O3/c1-16-11-18(26-4)19(27-5)12-17(16)13-23(2)14-20(25)24(3)21(15-22)9-7-6-8-10-21/h11-12H,6-10,13-14H2,1-5H3/p+1