[2-ethoxy-4-[(E)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]phenyl] ethanoate

Systemtic Name: [2-ethoxy-4-[(E)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]phenyl] ethanoate Openeye Name: [2-ethoxy-4-[(E)-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-ylidene)methyl]phenyl] acetate CAS Name: acetic acid [2-ethoxy-4-[(E)-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-ylidene)methyl]phenyl] acetate Traditional Name: acetic acid [2-ethoxy-4-[(E)-(5-keto-3-methylene-1-phenyl-pyrazolidin-4-ylidene)methyl]phenyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=C)NN(C2=O)C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\C(=C)NN(C2=O)C3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C21H20N2O4/c1-4-26-20-13-16(10-11-19(20)27-15(3)24)12-18-14(2)22-23(21(18)25)17-8-6-5-7-9-17/h5-13,22H,2,4H2,1,3H3/b18-12+