[3-(2-chloranylethanoylamino)-1,5,5-trimethyl-cyclohex-2-en-1-yl]-dimethyl-prop-2-enyl-azanium

Systemtic Name: [3-(2-chloranylethanoylamino)-1,5,5-trimethyl-cyclohex-2-en-1-yl]-dimethyl-prop-2-enyl-azanium Openeye Name: allyl-[3-[(2-chloroacetyl)amino]-1,5,5-trimethyl-cyclohex-2-en-1-yl]-dimethyl-ammonium CAS Name: [3-[(2-chloro-1-oxoethyl)amino]-1,5,5-trimethyl-1-cyclohex-2-enyl]-dimethyl-prop-2-enylammonium IUPAC Name: [3-[(2-chloroacetyl)amino]-1,5,5-trimethylcyclohex-2-en-1-yl]-dimethyl-prop-2-enylazanium Traditional Name: allyl-[3-[(2-chloroacetyl)amino]-1,5,5-trimethyl-cyclohex-2-en-1-yl]-dimethyl-ammonium Formula: C16H28ClN2O+ MolecularWeight: 299.85932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(C1)(C)[N+](C)(C)CC=C)NC(=O)CCl)C

Isomeric SMILES

CC1(CC(=CC(C1)(C)[N+](C)(C)CC=C)NC(=O)CCl)C

InChI

InChI=1S/C16H27ClN2O/c1-7-8-19(5,6)16(4)10-13(18-14(20)11-17)9-15(2,3)12-16/h7,10H,1,8-9,11-12H2,2-6H3/p+1