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

Systemtic Name: 1,3-bis(azanyl)-6-(1,4-dioxan-2-yl)-7-oxidanyl-9,9a-dihydro-4aH-xanthene-2-carbonitrile Openeye Name: 1,3-diamino-6-(1,4-dioxan-2-yl)-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile CAS Name: 1,3-diamino-6-(1,4-dioxan-2-yl)-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile IUPAC Name: 1,3-diamino-6-(1,4-dioxan-2-yl)-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Traditional Name: 1,3-diamino-6-(1,4-dioxan-2-yl)-7-hydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CO1)C2=CC3=C(CC4C(O3)C=C(C(=C4N)C#N)N)C=C2O

Isomeric SMILES

C1COC(CO1)C2=CC3=C(CC4C(O3)C=C(C(=C4N)C#N)N)C=C2O

InChI

InChI=1S/C18H19N3O4/c19-7-12-13(20)6-16-11(18(12)21)3-9-4-14(22)10(5-15(9)25-16)17-8-23-1-2-24-17/h4-6,11,16-17,22H,1-3,8,20-21H2