3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]benzoic acid

Systemtic Name: 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]benzoic acid Openeye Name: 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]benzoic acid CAS Name: 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]benzoic acid IUPAC Name: 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]benzoic acid Traditional Name: 3-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]benzoic acid Formula: C24H20BrNO3 MolecularWeight: 450.3245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)C4=CC(=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)C4=CC(=CC=C4)C(=O)O

InChI

InChI=1S/C24H20BrNO3/c1-15-23(17-4-3-5-18(12-17)24(27)28)21-13-20(29-2)10-11-22(21)26(15)14-16-6-8-19(25)9-7-16/h3-13H,14H2,1-2H3,(H,27,28)