[2-(4-chlorophenyl)-2-oxidanyl-ethyl]-bis(3-methylbutyl)azanium

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanyl-ethyl]-bis(3-methylbutyl)azanium Openeye Name: [2-(4-chlorophenyl)-2-hydroxy-ethyl]-diisopentyl-ammonium CAS Name: [2-(4-chlorophenyl)-2-hydroxyethyl]-bis(3-methylbutyl)ammonium IUPAC Name: [2-(4-chlorophenyl)-2-hydroxyethyl]-bis(3-methylbutyl)azanium Traditional Name: [2-(4-chlorophenyl)-2-hydroxy-ethyl]-diisoamyl-ammonium Formula: C18H31ClNO+ MolecularWeight: 312.89784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH+](CCC(C)C)CC(C1=CC=C(C=C1)Cl)O

Isomeric SMILES

CC(C)CC[NH+](CCC(C)C)CC(C1=CC=C(C=C1)Cl)O

InChI

InChI=1S/C18H30ClNO/c1-14(2)9-11-20(12-10-15(3)4)13-18(21)16-5-7-17(19)8-6-16/h5-8,14-15,18,21H,9-13H2,1-4H3/p+1