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

Systemtic Name: butyl 4-[[4-(2-ethoxy-2-oxidanylidene-ethyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[4-(2-ethoxy-2-oxo-ethyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-(2-ethoxy-2-oxoethyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[4-(2-ethoxy-2-oxoethyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-(2-ethoxy-2-keto-ethyl)piperazine-1-carbonyl]amino]benzoic acid butyl ester Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC(=O)OCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC(=O)OCC

InChI

InChI=1S/C20H29N3O5/c1-3-5-14-28-19(25)16-6-8-17(9-7-16)21-20(26)23-12-10-22(11-13-23)15-18(24)27-4-2/h6-9H,3-5,10-15H2,1-2H3,(H,21,26)