1-[(2-bromanyl-4,5-dimethoxy-phenyl)-naphthalen-1-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)-naphthalen-1-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(1-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(1-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-naphthalen-1-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(1-naphthyl)methyl]proline Formula: C24H24BrNO4 MolecularWeight: 470.35566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC4C(=O)O)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC4C(=O)O)Br)OC

InChI

InChI=1S/C24H24BrNO4/c1-29-21-13-18(19(25)14-22(21)30-2)23(26-12-6-11-20(26)24(27)28)17-10-5-8-15-7-3-4-9-16(15)17/h3-5,7-10,13-14,20,23H,6,11-12H2,1-2H3,(H,27,28)