[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-5-methoxy-4-propoxy-benzoate

Systemtic Name: [2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-5-methoxy-4-propoxy-benzoate Openeye Name: [2-(4-morpholinoanilino)-2-oxo-ethyl] 3-chloro-5-methoxy-4-propoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-propoxybenzoic acid [2-[4-(4-morpholinyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylanilino)-2-oxoethyl] 3-chloro-5-methoxy-4-propoxybenzoate Traditional Name: 3-chloro-5-methoxy-4-propoxy-benzoic acid [2-keto-2-(4-morpholinoanilino)ethyl] ester Formula: C23H27ClN2O6 MolecularWeight: 462.92328

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCOCC3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCOCC3)OC

InChI

InChI=1S/C23H27ClN2O6/c1-3-10-31-22-19(24)13-16(14-20(22)29-2)23(28)32-15-21(27)25-17-4-6-18(7-5-17)26-8-11-30-12-9-26/h4-7,13-14H,3,8-12,15H2,1-2H3,(H,25,27)