1,3-bis(azanyl)-6-ethoxy-7-oxidanyl-9,9a-dihydro-4aH-xanthene-2-carbonitrile

Systemtic Name: 1,3-bis(azanyl)-6-ethoxy-7-oxidanyl-9,9a-dihydro-4aH-xanthene-2-carbonitrile Openeye Name: 1,3-diamino-6-ethoxy-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile CAS Name: 1,3-diamino-6-ethoxy-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile IUPAC Name: 1,3-diamino-6-ethoxy-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Traditional Name: 1,3-diamino-6-ethoxy-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CC3C(C=C(C(=C3N)C#N)N)OC2=C1)O

Isomeric SMILES

CCOC1=C(C=C2CC3C(C=C(C(=C3N)C#N)N)OC2=C1)O

InChI

InChI=1S/C16H17N3O3/c1-2-21-15-6-13-8(4-12(15)20)3-9-14(22-13)5-11(18)10(7-17)16(9)19/h4-6,9,14,20H,2-3,18-19H2,1H3