7-methyl-4-oxidanylidene-2-phenyl-5,6-dihydropyrazolo[3,4-b]azepin-3-olate

Systemtic Name: 7-methyl-4-oxidanylidene-2-phenyl-5,6-dihydropyrazolo[3,4-b]azepin-3-olate Openeye Name: 7-methyl-4-oxo-2-phenyl-5,6-dihydropyrazolo[3,4-b]azepin-3-olate CAS Name: 7-methyl-4-oxo-2-phenyl-5,6-dihydropyrazolo[3,4-b]azepin-3-olate IUPAC Name: 7-methyl-4-oxo-2-phenyl-5,6-dihydropyrazolo[3,4-b]azepin-3-olate Traditional Name: 4-keto-7-methyl-2-phenyl-5,6-dihydropyrazol[3,4-b]azepin-3-olate Formula: C14H12N3O2- MolecularWeight: 254.26398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NN(C(=C2C(=O)CC1)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC2=NN(C(=C2C(=O)CC1)[O-])C3=CC=CC=C3

InChI

InChI=1S/C14H13N3O2/c1-9-7-8-11(18)12-13(15-9)16-17(14(12)19)10-5-3-2-4-6-10/h2-6,19H,7-8H2,1H3/p-1