4-[[(E)-(3-ethoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[(E)-(3-ethoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[(E)-(3-ethoxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[(E)-(3-ethoxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[(E)-(3-ethoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[(E)-(3-ethoxy-4-keto-5-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C=C(C1=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C/C(=C/NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)/C=C(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5/c1-4-29-17-11-14(10-16(19(17)25)24(27)28)12-21-18-13(2)22(3)23(20(18)26)15-8-6-5-7-9-15/h5-12,21H,4H2,1-3H3/b14-12+