1-[(2S)-1-[(2-bromophenyl)carbamoyl]pyrrolidin-2-yl]carbonyl-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2S)-1-[(2-bromophenyl)carbamoyl]pyrrolidin-2-yl]carbonyl-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(2S)-1-[(2-bromophenyl)carbamoyl]pyrrolidine-2-carbonyl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-[[(2S)-1-[(2-bromoanilino)-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-N-[(3-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2S)-1-[(2-bromophenyl)carbamoyl]pyrrolidine-2-carbonyl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-[(2S)-1-[(2-bromophenyl)carbamoyl]prolyl]-N-m-anisyl-isonipecotamide Formula: C26H31BrN4O4 MolecularWeight: 543.45274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2CCN(CC2)C(=O)C3CCCN3C(=O)NC4=CC=CC=C4Br

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2CCN(CC2)C(=O)[C@@H]3CCCN3C(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C26H31BrN4O4/c1-35-20-7-4-6-18(16-20)17-28-24(32)19-11-14-30(15-12-19)25(33)23-10-5-13-31(23)26(34)29-22-9-3-2-8-21(22)27/h2-4,6-9,16,19,23H,5,10-15,17H2,1H3,(H,28,32)(H,29,34)/t23-/m0/s1