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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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