ethyl 4-[[(E)-2-cyano-3-[3-methoxy-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-2-cyano-3-[3-methoxy-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-2-cyano-3-[3-methoxy-4-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-[3-methoxy-4-[2-oxo-2-(1-pyrrolidinyl)ethoxy]phenyl]-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-2-cyano-3-[3-methoxy-4-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-[4-(2-keto-2-pyrrolidino-ethoxy)-3-methoxy-phenyl]acryloyl]amino]benzoic acid ethyl ester Formula: C26H27N3O6 MolecularWeight: 477.50908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC(=O)N3CCCC3)OC)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OCC(=O)N3CCCC3)OC)/C#N

InChI

InChI=1S/C26H27N3O6/c1-3-34-26(32)19-7-9-21(10-8-19)28-25(31)20(16-27)14-18-6-11-22(23(15-18)33-2)35-17-24(30)29-12-4-5-13-29/h6-11,14-15H,3-5,12-13,17H2,1-2H3,(H,28,31)/b20-14+