[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-chloranyl-6-ethoxy-phenyl] 3-methylbenzoate

Systemtic Name: [4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-chloranyl-6-ethoxy-phenyl] 3-methylbenzoate Openeye Name: [2-chloro-4-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-ethoxy-phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-chloro-4-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-6-ethoxyphenyl] ester IUPAC Name: [2-chloro-4-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-6-ethoxyphenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-chloro-4-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-ethoxy-phenyl] ester Formula: C26H21ClN2O5 MolecularWeight: 476.90834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Cl)OC(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Cl)OC(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C26H21ClN2O5/c1-3-33-22-15-17(13-20-24(30)28-29(25(20)31)19-10-5-4-6-11-19)14-21(27)23(22)34-26(32)18-9-7-8-16(2)12-18/h4-15H,3H2,1-2H3,(H,28,30)