ethyl 4-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-(2-morpholino-2-oxo-ethyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-(2-keto-2-morpholino-ethyl)piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC(=O)N3CCOCC3

InChI

InChI=1S/C20H28N4O5/c1-2-29-19(26)16-3-5-17(6-4-16)21-20(27)24-9-7-22(8-10-24)15-18(25)23-11-13-28-14-12-23/h3-6H,2,7-15H2,1H3,(H,21,27)