3-azanyl-4-[[2-(phenylmethyl)-1,3-dihydropyrazol-4-yl]imino]cyclohexa-2,5-dien-1-one

Systemtic Name: 3-azanyl-4-[[2-(phenylmethyl)-1,3-dihydropyrazol-4-yl]imino]cyclohexa-2,5-dien-1-one Openeye Name: 3-amino-4-[(2-benzyl-1,3-dihydropyrazol-4-yl)imino]cyclohexa-2,5-dien-1-one CAS Name: 3-amino-4-[[2-(phenylmethyl)-1,3-dihydropyrazol-4-yl]imino]-1-cyclohexa-2,5-dienone IUPAC Name: 3-amino-4-[(2-benzyl-1,3-dihydropyrazol-4-yl)imino]cyclohexa-2,5-dien-1-one Traditional Name: 3-amino-4-[(1-benzyl-3-pyrazolin-4-yl)imino]cyclohexa-2,5-dien-1-one Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CNN1CC2=CC=CC=C2)N=C3C=CC(=O)C=C3N

Isomeric SMILES

C1C(=CNN1CC2=CC=CC=C2)N=C3C=CC(=O)C=C3N

InChI

InChI=1S/C16H16N4O/c17-15-8-14(21)6-7-16(15)19-13-9-18-20(11-13)10-12-4-2-1-3-5-12/h1-9,18H,10-11,17H2