disodium (3R,4R,6S)-4-azanyl-3-(3-oxidanidyl-3-oxidanylidene-prop-1-en-2-yl)oxy-6-oxidanyl-cyclohexene-1-carboxylate

Systemtic Name: disodium (3R,4R,6S)-4-azanyl-3-(3-oxidanidyl-3-oxidanylidene-prop-1-en-2-yl)oxy-6-oxidanyl-cyclohexene-1-carboxylate Openeye Name: disodium (3R,4R,6S)-4-amino-3-(1-carboxylatovinyloxy)-6-hydroxy-cyclohexene-1-carboxylate CAS Name: disodium (3R,4R,6S)-4-amino-6-hydroxy-3-(3-oxido-3-oxoprop-1-en-2-yl)oxy-1-cyclohexenecarboxylate IUPAC Name: disodium (3R,4R,6S)-4-amino-6-hydroxy-3-(3-oxido-3-oxoprop-1-en-2-yl)oxycyclohexene-1-carboxylate Traditional Name: disodium (3R,4R,6S)-4-amino-3-(1-carboxylatovinyloxy)-6-hydroxy-cyclohexene-1-carboxylate Formula: C10H11NNa2O6 MolecularWeight: 287.17698

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)[O-])OC1C=C(C(CC1N)O)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C=C(C(=O)[O-])O[C@@H]1C=C([C@H](C[C@H]1N)O)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C10H13NO6.2Na/c1-4(9(13)14)17-8-2-5(10(15)16)7(12)3-6(8)11;;/h2,6-8,12H,1,3,11H2,(H,13,14)(H,15,16);;/q;2*+1/p-2/t6-,7+,8-;;/m1../s1