ethyl 4-[[1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[1-(4-ethoxyphenyl)-5-oxo-pyrrolidin-3-yl]carbamoylamino]benzoate CAS Name: 4-[[[[1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]benzoate Traditional Name: 4-[(5-keto-1-p-phenetyl-pyrrolidin-3-yl)carbamoylamino]benzoic acid ethyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)NC(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2CC(CC2=O)NC(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C22H25N3O5/c1-3-29-19-11-9-18(10-12-19)25-14-17(13-20(25)26)24-22(28)23-16-7-5-15(6-8-16)21(27)30-4-2/h5-12,17H,3-4,13-14H2,1-2H3,(H2,23,24,28)