3-(2-methylprop-1-enyl)-3-[(1-oxidanidylpyrazin-1-ium-2-yl)methyl]-4-oxidanyl-cyclohexa-1,5-diene-1-carbonitrile

Systemtic Name: 3-(2-methylprop-1-enyl)-3-[(1-oxidanidylpyrazin-1-ium-2-yl)methyl]-4-oxidanyl-cyclohexa-1,5-diene-1-carbonitrile Openeye Name: 4-hydroxy-3-(2-methylprop-1-enyl)-3-[(1-oxidopyrazin-1-ium-2-yl)methyl]cyclohexa-1,5-diene-1-carbonitrile CAS Name: 4-hydroxy-3-(2-methylprop-1-enyl)-3-[(1-oxido-2-pyrazin-1-iumyl)methyl]-1-cyclohexa-1,5-dienecarbonitrile IUPAC Name: 4-hydroxy-3-(2-methylprop-1-enyl)-3-[(1-oxidopyrazin-1-ium-2-yl)methyl]cyclohexa-1,5-diene-1-carbonitrile Traditional Name: 4-hydroxy-3-(2-methylprop-1-enyl)-3-[(1-oxidopyrazin-1-ium-2-yl)methyl]cyclohexa-1,5-diene-1-carbonitrile Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1(C=C(C=CC1O)C#N)CC2=[N+](C=CN=C2)[O-])C

Isomeric SMILES

CC(=CC1(C=C(C=CC1O)C#N)CC2=[N+](C=CN=C2)[O-])C

InChI

InChI=1S/C16H17N3O2/c1-12(2)7-16(8-13(10-17)3-4-15(16)20)9-14-11-18-5-6-19(14)21/h3-8,11,15,20H,9H2,1-2H3