methyl 4-[(E)-3-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethoxy]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethoxy]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxo-ethoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[2-[(2-cyclopentyl-3-pyrazolyl)amino]-2-oxoethoxy]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethoxy]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-keto-ethoxy]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)OCC(=O)NC2=CC=NN2C3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)OCC(=O)NC2=CC=NN2C3CCCC3

InChI

InChI=1S/C21H23N3O5/c1-28-21(27)16-9-6-15(7-10-16)8-11-20(26)29-14-19(25)23-18-12-13-22-24(18)17-4-2-3-5-17/h6-13,17H,2-5,14H2,1H3,(H,23,25)/b11-8+