[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: [2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate Openeye Name: [2-(4-morpholinoanilino)-2-oxo-ethyl] 3-ethoxy-4-isobutoxy-benzoate CAS Name: 3-ethoxy-4-(2-methylpropoxy)benzoic acid [2-[4-(4-morpholinyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylanilino)-2-oxoethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-ethoxy-4-isobutoxy-benzoic acid [2-keto-2-(4-morpholinoanilino)ethyl] ester Formula: C25H32N2O6 MolecularWeight: 456.53138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCOCC3)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCOCC3)OCC(C)C

InChI

InChI=1S/C25H32N2O6/c1-4-31-23-15-19(5-10-22(23)32-16-18(2)3)25(29)33-17-24(28)26-20-6-8-21(9-7-20)27-11-13-30-14-12-27/h5-10,15,18H,4,11-14,16-17H2,1-3H3,(H,26,28)