3,3-dimethyl-6-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-6-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3,3-dimethyl-6-[(6-nitro-2-oxo-chromene-3-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3,3-dimethyl-6-[[(6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3,3-dimethyl-6-[(6-nitro-2-oxochromene-3-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 7-keto-6-[(2-keto-6-nitro-chromene-3-carbonyl)amino]-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C18H15N3O8S MolecularWeight: 433.392

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O)C(=O)O)C

InChI

InChI=1S/C18H15N3O8S/c1-18(2)12(16(24)25)20-14(23)11(15(20)30-18)19-13(22)9-6-7-5-8(21(27)28)3-4-10(7)29-17(9)26/h3-6,11-12,15H,1-2H3,(H,19,22)(H,24,25)