N-[1-(4-bromophenyl)ethyl]-2,3-bis(oxidanyl)-4-oxidanylidene-4-(2-phenylpyrrolidin-1-yl)butanamide

Systemtic Name: N-[1-(4-bromophenyl)ethyl]-2,3-bis(oxidanyl)-4-oxidanylidene-4-(2-phenylpyrrolidin-1-yl)butanamide Openeye Name: N-[1-(4-bromophenyl)ethyl]-2,3-dihydroxy-4-oxo-4-(2-phenylpyrrolidin-1-yl)butanamide CAS Name: N-[1-(4-bromophenyl)ethyl]-2,3-dihydroxy-4-oxo-4-(2-phenyl-1-pyrrolidinyl)butanamide IUPAC Name: N-[1-(4-bromophenyl)ethyl]-2,3-dihydroxy-4-oxo-4-(2-phenylpyrrolidin-1-yl)butanamide Traditional Name: N-[1-(4-bromophenyl)ethyl]-2,3-dihydroxy-4-keto-4-(2-phenylpyrrolidino)butyramide Formula: C22H25BrN2O4 MolecularWeight: 461.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)C(C(C(=O)N2CCCC2C3=CC=CC=C3)O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=O)C(C(C(=O)N2CCCC2C3=CC=CC=C3)O)O

InChI

InChI=1S/C22H25BrN2O4/c1-14(15-9-11-17(23)12-10-15)24-21(28)19(26)20(27)22(29)25-13-5-8-18(25)16-6-3-2-4-7-16/h2-4,6-7,9-12,14,18-20,26-27H,5,8,13H2,1H3,(H,24,28)