[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] 3-ethoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-ethoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-keto-2-morpholino-ethoxy)benzoic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C21H30N2O7 MolecularWeight: 422.4721

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC(C)C)OCC(=O)N2CCOCC2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC(C)C)OCC(=O)N2CCOCC2

InChI

InChI=1S/C21H30N2O7/c1-4-28-18-11-16(21(26)30-13-19(24)22-12-15(2)3)5-6-17(18)29-14-20(25)23-7-9-27-10-8-23/h5-6,11,15H,4,7-10,12-14H2,1-3H3,(H,22,24)