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

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)-(2-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-methoxyphenyl)-(2-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)-naphthalen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-methoxy-phenyl)-(2-naphthyl)methyl]proline Formula: C23H22BrNO3 MolecularWeight: 440.32968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O

InChI

InChI=1S/C23H22BrNO3/c1-28-21-11-10-18(24)14-19(21)22(25-12-4-7-20(25)23(26)27)17-9-8-15-5-2-3-6-16(15)13-17/h2-3,5-6,8-11,13-14,20,22H,4,7,12H2,1H3,(H,26,27)