[3-[[3-(3-ethoxy-2-phenoxycarbonyloxy-propoxy)phenyl]amino]-3-oxidanylidene-propyl]-dimethyl-sulfanium

Systemtic Name: [3-[[3-(3-ethoxy-2-phenoxycarbonyloxy-propoxy)phenyl]amino]-3-oxidanylidene-propyl]-dimethyl-sulfanium Openeye Name: [3-[3-(3-ethoxy-2-phenoxycarbonyloxy-propoxy)anilino]-3-oxo-propyl]-dimethyl-sulfonium CAS Name: [3-[3-[3-ethoxy-2-[oxo(phenoxy)methoxy]propoxy]anilino]-3-oxopropyl]-dimethylsulfonium IUPAC Name: [3-[3-(3-ethoxy-2-phenoxycarbonyloxypropoxy)anilino]-3-oxopropyl]-dimethylsulfanium Traditional Name: [3-[3-(2-carbophenoxyoxy-3-ethoxy-propoxy)anilino]-3-keto-propyl]-dimethyl-sulfonium Formula: C23H30NO6S+ MolecularWeight: 448.5524

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(COC1=CC=CC(=C1)NC(=O)CC[S+](C)C)OC(=O)OC2=CC=CC=C2

Isomeric SMILES

CCOCC(COC1=CC=CC(=C1)NC(=O)CC[S+](C)C)OC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C23H29NO6S/c1-4-27-16-21(30-23(26)29-19-10-6-5-7-11-19)17-28-20-12-8-9-18(15-20)24-22(25)13-14-31(2)3/h5-12,15,21H,4,13-14,16-17H2,1-3H3/p+1