(3E)-6-azanyl-4-oxidanylidene-3-[1-(prop-2-enylamino)ethylidene]cyclohexa-1,5-diene-1-carbonitrile

Systemtic Name: (3E)-6-azanyl-4-oxidanylidene-3-[1-(prop-2-enylamino)ethylidene]cyclohexa-1,5-diene-1-carbonitrile Openeye Name: (3E)-3-[1-(allylamino)ethylidene]-6-amino-4-oxo-cyclohexa-1,5-diene-1-carbonitrile CAS Name: (3E)-6-amino-4-oxo-3-[1-(prop-2-enylamino)ethylidene]-1-cyclohexa-1,5-dienecarbonitrile IUPAC Name: (3E)-6-amino-4-oxo-3-[1-(prop-2-enylamino)ethylidene]cyclohexa-1,5-diene-1-carbonitrile Traditional Name: (3E)-3-[1-(allylamino)ethylidene]-6-amino-4-keto-cyclohexa-1,5-diene-1-carbonitrile Formula: C12H13N3O MolecularWeight: 215.25112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=C(C(=CC1=O)N)C#N)NCC=C

Isomeric SMILES

C/C(=C\1/C=C(C(=CC1=O)N)C#N)/NCC=C

InChI

InChI=1S/C12H13N3O/c1-3-4-15-8(2)10-5-9(7-13)11(14)6-12(10)16/h3,5-6,15H,1,4,14H2,2H3/b10-8+