3-[2-[4-(2-chlorophenyl)piperazin-1-yl]carbonylpyrrolidin-1-yl]carbonyloxirane-2-carboxylic acid

Systemtic Name: 3-[2-[4-(2-chlorophenyl)piperazin-1-yl]carbonylpyrrolidin-1-yl]carbonyloxirane-2-carboxylic acid Openeye Name: 3-[2-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidine-1-carbonyl]oxirane-2-carboxylic acid CAS Name: 3-[[2-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-oxomethyl]-2-oxiranecarboxylic acid IUPAC Name: 3-[2-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidine-1-carbonyl]oxirane-2-carboxylic acid Traditional Name: 3-[2-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidine-1-carbonyl]oxirane-2-carboxylic acid Formula: C19H22ClN3O5 MolecularWeight: 407.84808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2C(O2)C(=O)O)C(=O)N3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C2C(O2)C(=O)O)C(=O)N3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H22ClN3O5/c20-12-4-1-2-5-13(12)21-8-10-22(11-9-21)17(24)14-6-3-7-23(14)18(25)15-16(28-15)19(26)27/h1-2,4-5,14-16H,3,6-11H2,(H,26,27)