2-[1-[4-(4-carbamothioylphenyl)-4-oxidanylidene-butanoyl]piperidin-4-yl]oxyethanoic acid

Systemtic Name: 2-[1-[4-(4-carbamothioylphenyl)-4-oxidanylidene-butanoyl]piperidin-4-yl]oxyethanoic acid Openeye Name: 2-[[1-[4-(4-carbamothioylphenyl)-4-oxo-butanoyl]-4-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[4-(4-carbamothioylphenyl)-1,4-dioxobutyl]-4-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[4-(4-carbamothioylphenyl)-4-oxobutanoyl]piperidin-4-yl]oxyacetic acid Traditional Name: 2-[[1-[4-keto-4-(4-thiocarbamoylphenyl)butanoyl]-4-piperidyl]oxy]acetic acid Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC(=O)O)C(=O)CCC(=O)C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1CN(CCC1OCC(=O)O)C(=O)CCC(=O)C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C18H22N2O5S/c19-18(26)13-3-1-12(2-4-13)15(21)5-6-16(22)20-9-7-14(8-10-20)25-11-17(23)24/h1-4,14H,5-11H2,(H2,19,26)(H,23,24)