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

Systemtic Name: 1,3-bis(azanyl)-5-oxidanyl-9,9a-dihydro-4aH-xanthene-2-carbonitrile Openeye Name: 1,3-diamino-5-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile CAS Name: 1,3-diamino-5-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile IUPAC Name: 1,3-diamino-5-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Traditional Name: 1,3-diamino-5-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Formula: C14H13N3O2 MolecularWeight: 255.27192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O2/c15-6-9-10(16)5-12-8(13(9)17)4-7-2-1-3-11(18)14(7)19-12/h1-3,5,8,12,18H,4,16-17H2