2-chloranylethanoyl-(2,6-dimethylcyclohexen-1-yl)-(2-methylpropoxymethyl)-phenyl-azanium

Systemtic Name: 2-chloranylethanoyl-(2,6-dimethylcyclohexen-1-yl)-(2-methylpropoxymethyl)-phenyl-azanium Openeye Name: (2-chloroacetyl)-(2,6-dimethylcyclohexen-1-yl)-(isobutoxymethyl)-phenyl-ammonium CAS Name: (2-chloro-1-oxoethyl)-(2,6-dimethyl-1-cyclohexenyl)-(2-methylpropoxymethyl)-phenylammonium IUPAC Name: (2-chloroacetyl)-(2,6-dimethylcyclohexen-1-yl)-(2-methylpropoxymethyl)-phenylazanium Traditional Name: (2-chloroacetyl)-(2,6-dimethylcyclohexen-1-yl)-(isobutoxymethyl)-phenyl-ammonium Formula: C21H31ClNO2+ MolecularWeight: 364.92934

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=C1[N+](COCC(C)C)(C2=CC=CC=C2)C(=O)CCl)C

Isomeric SMILES

CC1CCCC(=C1[N+](COCC(C)C)(C2=CC=CC=C2)C(=O)CCl)C

InChI

InChI=1S/C21H31ClNO2/c1-16(2)14-25-15-23(20(24)13-22,19-11-6-5-7-12-19)21-17(3)9-8-10-18(21)4/h5-7,11-12,16-17H,8-10,13-15H2,1-4H3/q+1