1,3-bis(azanyl)-5,6-bis(oxidanyl)-9,9a-dihydro-4aH-xanthene-2-carbonitrile

Systemtic Name: 1,3-bis(azanyl)-5,6-bis(oxidanyl)-9,9a-dihydro-4aH-xanthene-2-carbonitrile Openeye Name: 1,3-diamino-5,6-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile CAS Name: 1,3-diamino-5,6-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile IUPAC Name: 1,3-diamino-5,6-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Traditional Name: 1,3-diamino-5,6-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C=C(C(=C2N)C#N)N)OC3=C1C=CC(=C3O)O

Isomeric SMILES

C1C2C(C=C(C(=C2N)C#N)N)OC3=C1C=CC(=C3O)O

InChI

InChI=1S/C14H13N3O3/c15-5-8-9(16)4-11-7(12(8)17)3-6-1-2-10(18)13(19)14(6)20-11/h1-2,4,7,11,18-19H,3,16-17H2