[[2-(4-but-2-ynylphenyl)-2-cyclohexyl-2-oxidanyl-ethanoyl]amino]-[2-(4-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [[2-(4-but-2-ynylphenyl)-2-cyclohexyl-2-oxidanyl-ethanoyl]amino]-[2-(4-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [[2-(4-but-2-ynylphenyl)-2-cyclohexyl-2-hydroxy-acetyl]amino]-[2-(4-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [[2-(4-but-2-ynylphenyl)-2-cyclohexyl-2-hydroxy-1-oxoethyl]amino]-[2-(4-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [[2-(4-but-2-ynylphenyl)-2-cyclohexyl-2-hydroxyacetyl]amino]-[2-(4-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [[2-(4-but-2-ynylphenyl)-2-cyclohexyl-2-hydroxy-acetyl]amino]-[2-(4-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C29H39N2O3+ MolecularWeight: 463.63156

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC1=CC=C(C=C1)C(C2CCCCC2)(C(=O)N[N+](C)(C)CCC3=CC=C(C=C3)OC)O

Isomeric SMILES

CC#CCC1=CC=C(C=C1)C(C2CCCCC2)(C(=O)N[N+](C)(C)CCC3=CC=C(C=C3)OC)O

InChI

InChI=1S/C29H38N2O3/c1-5-6-10-23-13-17-26(18-14-23)29(33,25-11-8-7-9-12-25)28(32)30-31(2,3)22-21-24-15-19-27(34-4)20-16-24/h13-20,25,33H,7-12,21-22H2,1-4H3/p+1