2-[2-[cyclopenten-1-yl(ethyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-[cyclopenten-1-yl(ethyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-[cyclopenten-1-yl(ethyl)amino]-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-[1-cyclopentenyl(ethyl)amino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-[cyclopenten-1-yl(ethyl)amino]-2-keto-ethyl]thio]benzoic acid Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CCCC1)C(=O)CSC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCN(C1=CCCC1)C(=O)CSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H19NO3S/c1-2-17(12-7-3-4-8-12)15(18)11-21-14-10-6-5-9-13(14)16(19)20/h5-7,9-10H,2-4,8,11H2,1H3,(H,19,20)