[1-[3-(1-azaniumyl-4-phenyl-butyl)oxiran-2-yl]-4-phenyl-butyl]azanium hydrochloride

Systemtic Name: [1-[3-(1-azaniumyl-4-phenyl-butyl)oxiran-2-yl]-4-phenyl-butyl]azanium hydrochloride Openeye Name: [1-[3-(1-azaniumyl-4-phenyl-butyl)oxiran-2-yl]-4-phenyl-butyl]ammonium hydrochloride CAS Name: [1-[3-(1-ammonio-4-phenylbutyl)-2-oxiranyl]-4-phenylbutyl]ammonium hydrochloride IUPAC Name: [1-[3-(1-azaniumyl-4-phenylbutyl)oxiran-2-yl]-4-phenylbutyl]azanium hydrochloride Traditional Name: [1-[3-(1-ammonio-4-phenyl-butyl)oxiran-2-yl]-4-phenyl-butyl]ammonium hydrochloride Formula: C22H33ClN2O+2 MolecularWeight: 376.96322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(C2C(O2)C(CCCC3=CC=CC=C3)[NH3+])[NH3+].Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCC(C2C(O2)C(CCCC3=CC=CC=C3)[NH3+])[NH3+].Cl

InChI

InChI=1S/C22H30N2O.ClH/c23-19(15-7-13-17-9-3-1-4-10-17)21-22(25-21)20(24)16-8-14-18-11-5-2-6-12-18;/h1-6,9-12,19-22H,7-8,13-16,23-24H2;1H/p+2