4-(6-azanyl-5-cyano-3,4,4-trimethyl-pyrano[2,3-c]pyrazol-1-yl)-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-(6-azanyl-5-cyano-3,4,4-trimethyl-pyrano[2,3-c]pyrazol-1-yl)-N-oxidanyl-benzeneamine oxide Openeye Name: 4-(6-amino-5-cyano-3,4,4-trimethyl-pyrano[2,3-c]pyrazol-1-yl)-N-hydroxy-benzeneamine oxide CAS Name: 4-(6-amino-5-cyano-3,4,4-trimethyl-1-pyrano[2,3-c]pyrazolyl)-N-hydroxybenzeneamine oxide IUPAC Name: 4-(6-amino-5-cyano-3,4,4-trimethylpyrano[2,3-c]pyrazol-1-yl)-N-hydroxybenzeneamine oxide Traditional Name: 4-(6-amino-5-cyano-3,4,4-trimethyl-pyrano[2,3-c]pyrazol-1-yl)-N-hydroxy-benzeneamine oxide Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)(C)C)C3=CC=C(C=C3)[NH+](O)[O-]

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)(C)C)C3=CC=C(C=C3)[NH+](O)[O-]

InChI

InChI=1S/C16H17N5O3/c1-9-13-15(24-14(18)12(8-17)16(13,2)3)20(19-9)10-4-6-11(7-5-10)21(22)23/h4-7,21-22H,18H2,1-3H3