1-[(2S)-1-[(4-bromanyl-2-chloranyl-phenyl)carbamoyl]pyrrolidin-2-yl]carbonyl-N-(4-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2S)-1-[(4-bromanyl-2-chloranyl-phenyl)carbamoyl]pyrrolidin-2-yl]carbonyl-N-(4-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(2S)-1-[(4-bromo-2-chloro-phenyl)carbamoyl]pyrrolidine-2-carbonyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[[(2S)-1-[(4-bromo-2-chloroanilino)-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-N-(4-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(2S)-1-[(4-bromo-2-chlorophenyl)carbamoyl]pyrrolidine-2-carbonyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[(2S)-1-[(4-bromo-2-chloro-phenyl)carbamoyl]prolyl]-N-(4-methoxyphenyl)isonipecotamide Formula: C25H28BrClN4O4 MolecularWeight: 563.87122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3CCCN3C(=O)NC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)[C@@H]3CCCN3C(=O)NC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C25H28BrClN4O4/c1-35-19-7-5-18(6-8-19)28-23(32)16-10-13-30(14-11-16)24(33)22-3-2-12-31(22)25(34)29-21-9-4-17(26)15-20(21)27/h4-9,15-16,22H,2-3,10-14H2,1H3,(H,28,32)(H,29,34)/t22-/m0/s1