ethyl 2-morpholin-4-yl-5-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 2-morpholin-4-yl-5-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 5-[[(E)-3-(4-isopropylphenyl)prop-2-enoyl]amino]-2-morpholino-benzoate CAS Name: 2-(4-morpholinyl)-5-[[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-morpholin-4-yl-5-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 2-morpholino-5-[[(E)-3-p-cumenylacryloyl]amino]benzoic acid ethyl ester Formula: C25H30N2O4 MolecularWeight: 422.5167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC=C(C=C2)C(C)C)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)C(C)C)N3CCOCC3

InChI

InChI=1S/C25H30N2O4/c1-4-31-25(29)22-17-21(10-11-23(22)27-13-15-30-16-14-27)26-24(28)12-7-19-5-8-20(9-6-19)18(2)3/h5-12,17-18H,4,13-16H2,1-3H3,(H,26,28)/b12-7+