[2-[3-(tert-butylazaniumyl)propylamino]-2-oxidanylidene-ethyl]-[(4-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[3-(tert-butylazaniumyl)propylamino]-2-oxidanylidene-ethyl]-[(4-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-[3-(tert-butylammonio)propylamino]-2-oxo-ethyl]-[(4-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-[3-(tert-butylammonio)propylamino]-2-oxoethyl]-[(4-methoxyphenyl)methyl]-methylammonium IUPAC Name: [2-[3-(tert-butylazaniumyl)propylamino]-2-oxoethyl]-[(4-methoxyphenyl)methyl]-methylazanium Traditional Name: [2-[3-(tert-butylammonio)propylamino]-2-keto-ethyl]-methyl-p-anisyl-ammonium Formula: C18H33N3O2+2 MolecularWeight: 323.47352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CCCNC(=O)C[NH+](C)CC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)(C)[NH2+]CCCNC(=O)C[NH+](C)CC1=CC=C(C=C1)OC

InChI

InChI=1S/C18H31N3O2/c1-18(2,3)20-12-6-11-19-17(22)14-21(4)13-15-7-9-16(23-5)10-8-15/h7-10,20H,6,11-14H2,1-5H3,(H,19,22)/p+2