1,5-dimethyl-4-[[(E)-(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[(E)-(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[[(E)-(6-oxo-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[(E)-(6-oxo-4-propoxy-1-cyclohexa-2,4-dienylidene)methyl]amino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[(E)-(6-oxo-4-propoxycyclohexa-2,4-dien-1-ylidene)methyl]amino]-2-phenylpyrazol-3-one Traditional Name: 4-[[(E)-(6-keto-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C=C1

Isomeric SMILES

CCCOC1=CC(=O)/C(=C/NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)/C=C1

InChI

InChI=1S/C21H23N3O3/c1-4-12-27-18-11-10-16(19(25)13-18)14-22-20-15(2)23(3)24(21(20)26)17-8-6-5-7-9-17/h5-11,13-14,22H,4,12H2,1-3H3/b16-14+