[(3R)-5-(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonyloxy-3-cyano-4-oxidanylidene-pent-1-en-2-yl]azanium

Systemtic Name: [(3R)-5-(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonyloxy-3-cyano-4-oxidanylidene-pent-1-en-2-yl]azanium Openeye Name: [(2R)-4-(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)oxy-2-cyano-1-methylene-3-oxo-butyl]ammonium CAS Name: [(3R)-5-[(2-acetamido-4,5-dimethyl-3-thiophenyl)-oxomethoxy]-3-cyano-4-oxopent-1-en-2-yl]ammonium IUPAC Name: [(3R)-5-(2-acetamido-4,5-dimethylthiophene-3-carbonyl)oxy-3-cyano-4-oxopent-1-en-2-yl]azanium Traditional Name: 1-[(1R)-3-(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)oxy-1-cyano-2-keto-propyl]vinylammonium Formula: C15H18N3O4S+ MolecularWeight: 336.38612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC(=O)C(C#N)C(=C)[NH3+])NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC(=O)[C@@H](C#N)C(=C)[NH3+])NC(=O)C)C

InChI

InChI=1S/C15H17N3O4S/c1-7-9(3)23-14(18-10(4)19)13(7)15(21)22-6-12(20)11(5-16)8(2)17/h11H,2,6,17H2,1,3-4H3,(H,18,19)/p+1/t11-/m0/s1