1-[3-nitro-4-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-nitro-4-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[4-(2-benzylbenzofuran-3-yl)phenyl]-3-nitro-phenyl]-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[3-nitro-4-[4-[2-(phenylmethyl)-3-benzofuranyl]phenyl]phenyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[4-(2-benzyl-1-benzofuran-3-yl)phenyl]-3-nitrophenyl]-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[4-(2-benzylbenzofuran-3-yl)phenyl]-3-nitro-phenyl]-4-hydroxy-proline Formula: C32H26N2O6 MolecularWeight: 534.55864

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C2=CC(=C(C=C2)C3=CC=C(C=C3)C4=C(OC5=CC=CC=C54)CC6=CC=CC=C6)[N+](=O)[O-])O

Isomeric SMILES

C1C(CN(C1C(=O)O)C2=CC(=C(C=C2)C3=CC=C(C=C3)C4=C(OC5=CC=CC=C54)CC6=CC=CC=C6)[N+](=O)[O-])O

InChI

InChI=1S/C32H26N2O6/c35-24-18-28(32(36)37)33(19-24)23-14-15-25(27(17-23)34(38)39)21-10-12-22(13-11-21)31-26-8-4-5-9-29(26)40-30(31)16-20-6-2-1-3-7-20/h1-15,17,24,28,35H,16,18-19H2,(H,36,37)