sodium (1Z)-N-(2-methoxycarbonylphenyl)sulfonyl-4-methyl-5-oxidanylidene-3-propoxy-1,2,4-triazole-1-carboximidate

Systemtic Name: sodium (1Z)-N-(2-methoxycarbonylphenyl)sulfonyl-4-methyl-5-oxidanylidene-3-propoxy-1,2,4-triazole-1-carboximidate Openeye Name: sodium (1Z)-N-(2-methoxycarbonylphenyl)sulfonyl-4-methyl-5-oxo-3-propoxy-1,2,4-triazole-1-carboximidate CAS Name: sodium (1Z)-N-(2-methoxycarbonylphenyl)sulfonyl-4-methyl-5-oxo-3-propoxy-1,2,4-triazole-1-carboximidate IUPAC Name: sodium (1Z)-N-(2-methoxycarbonylphenyl)sulfonyl-4-methyl-5-oxo-3-propoxy-1,2,4-triazole-1-carboximidate Traditional Name: sodium (1Z)-N-(2-carbomethoxyphenyl)sulfonyl-5-keto-4-methyl-3-propoxy-1,2,4-triazole-1-carboximidate Formula: C15H17N4NaO7S MolecularWeight: 420.37285

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=O)N1C)C(=NS(=O)(=O)C2=CC=CC=C2C(=O)OC)[O-].[Na+]

Isomeric SMILES

CCCOC1=NN(C(=O)N1C)/C(=N/S(=O)(=O)C2=CC=CC=C2C(=O)OC)/[O-].[Na+]

InChI

InChI=1S/C15H18N4O7S.Na/c1-4-9-26-14-16-19(15(22)18(14)2)13(21)17-27(23,24)11-8-6-5-7-10(11)12(20)25-3;/h5-8H,4,9H2,1-3H3,(H,17,21);/q;+1/p-1