1,5-dimethyl-4-[(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-phenyl-pyrazol-3-one Openeye Name: 4-[(5-allyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[(6-oxo-5-prop-2-enyl-1-cyclohexa-2,4-dienylidene)methylamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[(6-oxo-5-prop-2-enylcyclohexa-2,4-dien-1-ylidene)methylamino]-2-phenylpyrazol-3-one Traditional Name: 4-[(5-allyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C=CC=C(C3=O)CC=C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C=CC=C(C3=O)CC=C

InChI

InChI=1S/C21H21N3O2/c1-4-9-16-10-8-11-17(20(16)25)14-22-19-15(2)23(3)24(21(19)26)18-12-6-5-7-13-18/h4-8,10-14,22H,1,9H2,2-3H3