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

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

Systemtic Name:3-azanyl-1-(ethylamino)-6,7-bis(oxidanyl)-9,9a-dihydro-4aH-xanthene-2-carbonitrile
Openeye Name:3-amino-1-(ethylamino)-6,7-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile
CAS Name:3-amino-1-(ethylamino)-6,7-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile
IUPAC Name:3-amino-1-(ethylamino)-6,7-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile
Traditional Name:3-amino-1-(ethylamino)-6,7-dihydroxy-9,9a-dihydro-4aH-xanthene-2-carbonitrile
Formula: C16H17N3O3
MolecularWeight: 299.32448
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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=CC2C1CC3=CC(=C(C=C3O2)O)O)N)C#N


Isomeric SMILES

CCNC1=C(C(=CC2C1CC3=CC(=C(C=C3O2)O)O)N)C#N


InChI

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


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