(2R)-N-(4-acetamidocyclohexyl)-1-[2-(4-chloranylphenoxy)ethanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(4-acetamidocyclohexyl)-1-[2-(4-chloranylphenoxy)ethanoyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(4-acetamidocyclohexyl)-1-[2-(4-chlorophenoxy)acetyl]pyrrolidine-2-carboxamide CAS Name: (2R)-N-(4-acetamidocyclohexyl)-1-[2-(4-chlorophenoxy)-1-oxoethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(4-acetamidocyclohexyl)-1-[2-(4-chlorophenoxy)acetyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-N-(4-acetamidocyclohexyl)-1-[2-(4-chlorophenoxy)acetyl]pyrrolidine-2-carboxamide Formula: C21H28ClN3O4 MolecularWeight: 421.91772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC(CC1)NC(=O)C2CCCN2C(=O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1CCC(CC1)NC(=O)[C@H]2CCCN2C(=O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H28ClN3O4/c1-14(26)23-16-6-8-17(9-7-16)24-21(28)19-3-2-12-25(19)20(27)13-29-18-10-4-15(22)5-11-18/h4-5,10-11,16-17,19H,2-3,6-9,12-13H2,1H3,(H,23,26)(H,24,28)/t16?,17?,19-/m1/s1