(2R)-1-(3-bromophenyl)carbonyl-N-[4-[(4-methoxyphenyl)carbonylamino]cyclohexyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(3-bromophenyl)carbonyl-N-[4-[(4-methoxyphenyl)carbonylamino]cyclohexyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-(3-bromobenzoyl)-N-[4-[(4-methoxybenzoyl)amino]cyclohexyl]pyrrolidine-2-carboxamide CAS Name: (2R)-1-[(3-bromophenyl)-oxomethyl]-N-[4-[[(4-methoxyphenyl)-oxomethyl]amino]cyclohexyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(3-bromobenzoyl)-N-[4-[(4-methoxybenzoyl)amino]cyclohexyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-(3-bromobenzoyl)-N-[4-(p-anisoylamino)cyclohexyl]pyrrolidine-2-carboxamide Formula: C26H30BrN3O4 MolecularWeight: 528.4381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2CCC(CC2)NC(=O)C3CCCN3C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2CCC(CC2)NC(=O)[C@H]3CCCN3C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C26H30BrN3O4/c1-34-22-13-7-17(8-14-22)24(31)28-20-9-11-21(12-10-20)29-25(32)23-6-3-15-30(23)26(33)18-4-2-5-19(27)16-18/h2,4-5,7-8,13-14,16,20-21,23H,3,6,9-12,15H2,1H3,(H,28,31)(H,29,32)/t20?,21?,23-/m1/s1