[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-(phenylmethyl)-(1,3-thiazinan-2-ylidene)azanium

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-(phenylmethyl)-(1,3-thiazinan-2-ylidene)azanium Openeye Name: benzyl-[2-(4-methoxyphenyl)-2-oxo-ethyl]-(1,3-thiazinan-2-ylidene)ammonium CAS Name: [2-(4-methoxyphenyl)-2-oxoethyl]-(phenylmethyl)-(1,3-thiazinan-2-ylidene)ammonium IUPAC Name: benzyl-[2-(4-methoxyphenyl)-2-oxoethyl]-(1,3-thiazinan-2-ylidene)azanium Traditional Name: benzyl-[2-keto-2-(4-methoxyphenyl)ethyl]-(1,3-thiazinan-2-ylidene)ammonium Formula: C20H23N2O2S+ MolecularWeight: 355.47382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[N+](=C2NCCCS2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[N+](=C2NCCCS2)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2S/c1-24-18-10-8-17(9-11-18)19(23)15-22(20-21-12-5-13-25-20)14-16-6-3-2-4-7-16/h2-4,6-11H,5,12-15H2,1H3/p+1