ethyl 2-[2-[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 2-[[2-[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 2-[[2-[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acryloyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)OCC(=O)NC2=CC=CC=C2C(=O)OCC)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)OCC(=O)NC2=CC=CC=C2C(=O)OCC)C

InChI

InChI=1S/C24H27N3O5/c1-5-11-27-16(3)12-18(17(27)4)13-19(14-25)23(29)32-15-22(28)26-21-10-8-7-9-20(21)24(30)31-6-2/h7-10,12-13H,5-6,11,15H2,1-4H3,(H,26,28)/b19-13+