5-tert-butyl-4-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-tert-butyl-4-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-tert-butyl-4-[(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one CAS Name: 5-tert-butyl-4-[(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-tert-butyl-4-[(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-tert-butyl-4-[(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methyl]-2-phenyl-3-pyrazolin-3-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C=CC=C(C3=O)OC

Isomeric SMILES

CC(C)(C)C1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C=CC=C(C3=O)OC

InChI

InChI=1S/C21H22N2O3/c1-21(2,3)19-16(13-14-9-8-12-17(26-4)18(14)24)20(25)23(22-19)15-10-6-5-7-11-15/h5-13,22H,1-4H3