[3-[[4-(carboxymethyl)phenyl]amino]-3-oxidanylidene-propyl]-dimethyl-sulfanium

Systemtic Name: [3-[[4-(carboxymethyl)phenyl]amino]-3-oxidanylidene-propyl]-dimethyl-sulfanium Openeye Name: [3-[4-(carboxymethyl)anilino]-3-oxo-propyl]-dimethyl-sulfonium CAS Name: [3-[4-(carboxymethyl)anilino]-3-oxopropyl]-dimethylsulfonium IUPAC Name: [3-[4-(carboxymethyl)anilino]-3-oxopropyl]-dimethylsulfanium Traditional Name: [3-[4-(carboxymethyl)anilino]-3-keto-propyl]-dimethyl-sulfonium Formula: C13H18NO3S+ MolecularWeight: 268.35192

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](C)CCC(=O)NC1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

C[S+](C)CCC(=O)NC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C13H17NO3S/c1-18(2)8-7-12(15)14-11-5-3-10(4-6-11)9-13(16)17/h3-6H,7-9H2,1-2H3,(H-,14,15,16,17)/p+1