ethyl (E)-4-[2-[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]but-2-enoate

Systemtic Name: ethyl (E)-4-[2-[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]but-2-enoate Openeye Name: ethyl (E)-4-[2-[(Z)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]but-2-enoate CAS Name: (E)-4-[2-[(Z)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenoxy]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[2-[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenoxy]but-2-enoate Traditional Name: (E)-4-[2-[(Z)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]phenoxy]but-2-enoic acid ethyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCOC1=CC=CC=C1C=C2C(=NN(C2=O)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)/C=C/COC1=CC=CC=C1/C=C\2/C(=NN(C2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H22N2O4/c1-3-28-22(26)14-9-15-29-21-13-8-7-10-18(21)16-20-17(2)24-25(23(20)27)19-11-5-4-6-12-19/h4-14,16H,3,15H2,1-2H3/b14-9+,20-16-