(Z)-azanyl(azepin-3-ylidene)methanolate diphosphate

Systemtic Name: (Z)-azanyl(azepin-3-ylidene)methanolate diphosphate Openeye Name: (Z)-amino(azepin-3-ylidene)methanolate diphosphate CAS Name: (Z)-amino(3-azepinylidene)methanolate diphosphate IUPAC Name: (Z)-amino(azepin-3-ylidene)methanolate diphosphate Traditional Name: (Z)-amino(azepin-3-ylidene)methanolate diphosphate Formula: C7H7N2O9P2-7 MolecularWeight: 325.086002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N)[O-])C=NC=C1.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

C1=C/C(=C(\N)/[O-])/C=NC=C1.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C7H8N2O.2H3O4P/c8-7(10)6-3-1-2-4-9-5-6;2*1-5(2,3)4/h1-5,10H,8H2;2*(H3,1,2,3,4)/p-7/b7-6-;;