N-[2-oxidanylidene-1-[(4-phenoxyphenyl)methyl]pyrrolidin-1-ium-1-yl]sulfanylcarbamate

Systemtic Name: N-[2-oxidanylidene-1-[(4-phenoxyphenyl)methyl]pyrrolidin-1-ium-1-yl]sulfanylcarbamate Openeye Name: N-[2-oxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-1-ium-1-yl]sulfanylcarbamate CAS Name: N-[[2-oxo-1-[(4-phenoxyphenyl)methyl]-1-pyrrolidin-1-iumyl]thio]carbamate IUPAC Name: N-[2-oxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-1-ium-1-yl]sulfanylcarbamate Traditional Name: N-[[2-keto-1-(4-phenoxybenzyl)pyrrolidin-1-ium-1-yl]thio]carbamate Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)[N+](C1)(CC2=CC=C(C=C2)OC3=CC=CC=C3)SNC(=O)[O-]

Isomeric SMILES

C1CC(=O)[N+](C1)(CC2=CC=C(C=C2)OC3=CC=CC=C3)SNC(=O)[O-]

InChI

InChI=1S/C18H18N2O4S/c21-17-7-4-12-20(17,25-19-18(22)23)13-14-8-10-16(11-9-14)24-15-5-2-1-3-6-15/h1-3,5-6,8-11,19H,4,7,12-13H2