4-[4-(4-chlorophenyl)-2-methyl-cyclohexyl]-N-(1-iodanylbutyl)morpholin-4-ium-4-amine

Systemtic Name: 4-[4-(4-chlorophenyl)-2-methyl-cyclohexyl]-N-(1-iodanylbutyl)morpholin-4-ium-4-amine Openeye Name: 4-[4-(4-chlorophenyl)-2-methyl-cyclohexyl]-N-(1-iodobutyl)morpholin-4-ium-4-amine CAS Name: 4-[4-(4-chlorophenyl)-2-methylcyclohexyl]-N-(1-iodobutyl)-4-morpholin-4-iumamine IUPAC Name: 4-[4-(4-chlorophenyl)-2-methylcyclohexyl]-N-(1-iodobutyl)morpholin-4-ium-4-amine Traditional Name: [4-[4-(4-chlorophenyl)-2-methyl-cyclohexyl]morpholin-4-ium-4-yl]-(1-iodobutyl)amine Formula: C21H33ClIN2O+ MolecularWeight: 491.85699

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(N[N+]1(CCOCC1)C2CCC(CC2C)C3=CC=C(C=C3)Cl)I

Isomeric SMILES

CCCC(N[N+]1(CCOCC1)C2CCC(CC2C)C3=CC=C(C=C3)Cl)I

InChI

InChI=1S/C21H33ClIN2O/c1-3-4-21(23)24-25(11-13-26-14-12-25)20-10-7-18(15-16(20)2)17-5-8-19(22)9-6-17/h5-6,8-9,16,18,20-21,24H,3-4,7,10-15H2,1-2H3/q+1