ethyl 4-[[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl]amino]benzoate CAS Name: 4-[[[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl]amino]benzoate Traditional Name: 4-[[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C22H21ClN4O4 MolecularWeight: 440.87954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCCC2C3=NC(=NO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCCC2C3=NC(=NO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H21ClN4O4/c1-2-30-21(28)14-8-10-17(11-9-14)24-22(29)27-12-4-7-18(27)20-25-19(26-31-20)15-5-3-6-16(23)13-15/h3,5-6,8-11,13,18H,2,4,7,12H2,1H3,(H,24,29)