2-[ethoxycarbonyl-[(2Z)-2-ethoxyimino-3-methoxy-3-oxidanylidene-propanoyl]amino]-2-methyl-3-(2-methyl-5-nitro-imidazol-1-yl)-4-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 2-[ethoxycarbonyl-[(2Z)-2-ethoxyimino-3-methoxy-3-oxidanylidene-propanoyl]amino]-2-methyl-3-(2-methyl-5-nitro-imidazol-1-yl)-4-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 2-[ethoxycarbonyl-[(2Z)-2-ethoxyimino-3-methoxy-3-oxo-propanoyl]amino]-2-methyl-3-(2-methyl-5-nitro-imidazol-1-yl)-4-oxo-azetidine-1-sulfonic acid CAS Name: 2-[ethoxycarbonyl-[(2Z)-2-ethoxyimino-3-methoxy-1,3-dioxopropyl]amino]-2-methyl-3-(2-methyl-5-nitro-1-imidazolyl)-4-oxo-1-azetidinesulfonic acid IUPAC Name: 2-[ethoxycarbonyl-[(2Z)-2-ethoxyimino-3-methoxy-3-oxopropanoyl]amino]-2-methyl-3-(2-methyl-5-nitroimidazol-1-yl)-4-oxoazetidine-1-sulfonic acid Traditional Name: 2-[carbethoxy-[(2Z)-2-ethyloximino-3-keto-3-methoxy-propanoyl]amino]-4-keto-2-methyl-3-(2-methyl-5-nitro-imidazol-1-yl)azetidine-1-sulfonic acid Formula: C17H22N6O12S MolecularWeight: 534.45458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C(=O)C(=NOCC)C(=O)OC)C1(C(C(=O)N1S(=O)(=O)O)N2C(=NC=C2[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)N(C(=O)/C(=N/OCC)/C(=O)OC)C1(C(C(=O)N1S(=O)(=O)O)N2C(=NC=C2[N+](=O)[O-])C)C

InChI

InChI=1S/C17H22N6O12S/c1-6-34-16(27)21(13(24)11(15(26)33-5)19-35-7-2)17(4)12(14(25)22(17)36(30,31)32)20-9(3)18-8-10(20)23(28)29/h8,12H,6-7H2,1-5H3,(H,30,31,32)/b19-11-