4-[(5-azanyl-3-oxidanylidene-1H-pyrazol-2-yl)methyl]-2-methoxy-benzenecarbonitrile

Systemtic Name: 4-[(5-azanyl-3-oxidanylidene-1H-pyrazol-2-yl)methyl]-2-methoxy-benzenecarbonitrile Openeye Name: 4-[(5-amino-3-oxo-1H-pyrazol-2-yl)methyl]-2-methoxy-benzonitrile CAS Name: 4-[(5-amino-3-oxo-1H-pyrazol-2-yl)methyl]-2-methoxybenzonitrile IUPAC Name: 4-[(5-amino-3-oxo-1H-pyrazol-2-yl)methyl]-2-methoxybenzonitrile Traditional Name: 4-[(3-amino-5-keto-3-pyrazolin-1-yl)methyl]-2-methoxy-benzonitrile Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2C(=O)C=C(N2)N)C#N

Isomeric SMILES

COC1=C(C=CC(=C1)CN2C(=O)C=C(N2)N)C#N

InChI

InChI=1S/C12H12N4O2/c1-18-10-4-8(2-3-9(10)6-13)7-16-12(17)5-11(14)15-16/h2-5,15H,7,14H2,1H3