[3-[3-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl]phenyl]-dimethyl-(phenylmethyl)azanium

Systemtic Name: [3-[3-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl]phenyl]-dimethyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[3-(3,4-dimethoxyphenyl)-3-oxo-propyl]phenyl]-dimethyl-ammonium CAS Name: [3-[3-(3,4-dimethoxyphenyl)-3-oxopropyl]phenyl]-dimethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[3-(3,4-dimethoxyphenyl)-3-oxopropyl]phenyl]-dimethylazanium Traditional Name: benzyl-[3-[3-(3,4-dimethoxyphenyl)-3-keto-propyl]phenyl]-dimethyl-ammonium Formula: C26H30NO3+ MolecularWeight: 404.5213

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=CC=C1)C2=CC=CC(=C2)CCC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[N+](C)(CC1=CC=CC=C1)C2=CC=CC(=C2)CCC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H30NO3/c1-27(2,19-21-9-6-5-7-10-21)23-12-8-11-20(17-23)13-15-24(28)22-14-16-25(29-3)26(18-22)30-4/h5-12,14,16-18H,13,15,19H2,1-4H3/q+1