[3-[[2-[3-butoxy-2-(2-phenoxyethanoyloxy)propoxy]phenyl]amino]-3-oxidanylidene-propyl]-dipropyl-sulfanium

Systemtic Name: [3-[[2-[3-butoxy-2-(2-phenoxyethanoyloxy)propoxy]phenyl]amino]-3-oxidanylidene-propyl]-dipropyl-sulfanium Openeye Name: [3-[2-[3-butoxy-2-(2-phenoxyacetyl)oxy-propoxy]anilino]-3-oxo-propyl]-dipropyl-sulfonium CAS Name: [3-[2-[3-butoxy-2-(1-oxo-2-phenoxyethoxy)propoxy]anilino]-3-oxopropyl]-dipropylsulfonium IUPAC Name: [3-[2-[3-butoxy-2-(2-phenoxyacetyl)oxypropoxy]anilino]-3-oxopropyl]-dipropylsulfanium Traditional Name: [3-[2-[3-butoxy-2-(2-phenoxyacetyl)oxy-propoxy]anilino]-3-keto-propyl]-dipropyl-sulfonium Formula: C30H44NO6S+ MolecularWeight: 546.73846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(COC1=CC=CC=C1NC(=O)CC[S+](CCC)CCC)OC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCCCOCC(COC1=CC=CC=C1NC(=O)CC[S+](CCC)CCC)OC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C30H43NO6S/c1-4-7-18-34-22-26(37-30(33)24-35-25-13-9-8-10-14-25)23-36-28-16-12-11-15-27(28)31-29(32)17-21-38(19-5-2)20-6-3/h8-16,26H,4-7,17-24H2,1-3H3/p+1