(Z)-2-[(2,2-dimethylcyclopropyl)carbonylamino]-8-(3-oxidanylpyridin-2-yl)sulfanyl-oct-2-enoic acid

Systemtic Name: (Z)-2-[(2,2-dimethylcyclopropyl)carbonylamino]-8-(3-oxidanylpyridin-2-yl)sulfanyl-oct-2-enoic acid Openeye Name: (Z)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]-8-[(3-hydroxy-2-pyridyl)sulfanyl]oct-2-enoic acid CAS Name: (Z)-2-[[(2,2-dimethylcyclopropyl)-oxomethyl]amino]-8-[(3-hydroxy-2-pyridinyl)thio]-2-octenoic acid IUPAC Name: (Z)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]-8-(3-hydroxypyridin-2-yl)sulfanyloct-2-enoic acid Traditional Name: (Z)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]-8-[(3-hydroxy-2-pyridyl)thio]oct-2-enoic acid Formula: C19H26N2O4S MolecularWeight: 378.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1C(=O)NC(=CCCCCCSC2=C(C=CC=N2)O)C(=O)O)C

Isomeric SMILES

CC1(CC1C(=O)N/C(=C\CCCCCSC2=C(C=CC=N2)O)/C(=O)O)C

InChI

InChI=1S/C19H26N2O4S/c1-19(2)12-13(19)16(23)21-14(18(24)25)8-5-3-4-6-11-26-17-15(22)9-7-10-20-17/h7-10,13,22H,3-6,11-12H2,1-2H3,(H,21,23)(H,24,25)/b14-8-