propan-2-yl 4-chloranyl-3-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]benzoate

Systemtic Name: propan-2-yl 4-chloranyl-3-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]benzoate Openeye Name: isopropyl 4-chloro-3-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzoate CAS Name: 4-chloro-3-[[5-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-2-pyrrolidinyl]methoxy]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-chloro-3-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzoate Traditional Name: 4-chloro-3-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzoic acid isopropyl ester Formula: C21H26ClN3O4 MolecularWeight: 419.90184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=C(C=C1)Cl)OCC2CCC(N2)C(=O)N3CCCC3C#N

Isomeric SMILES

CC(C)OC(=O)C1=CC(=C(C=C1)Cl)OCC2CCC(N2)C(=O)N3CCCC3C#N

InChI

InChI=1S/C21H26ClN3O4/c1-13(2)29-21(27)14-5-7-17(22)19(10-14)28-12-15-6-8-18(24-15)20(26)25-9-3-4-16(25)11-23/h5,7,10,13,15-16,18,24H,3-4,6,8-9,12H2,1-2H3