ethyl 5-[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethoxy]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[2-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-oxoethoxy]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-oxoethoxy]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethoxy]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)OCC(=O)C3=C(N(C(=C3)C)CC=C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)OCC(=O)C3=C(N(C(=C3)C)CC=C)C

InChI

InChI=1S/C23H25N3O4/c1-5-12-25-16(3)13-19(17(25)4)21(27)15-30-22-20(23(28)29-6-2)14-24-26(22)18-10-8-7-9-11-18/h5,7-11,13-14H,1,6,12,15H2,2-4H3