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

Systemtic Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-ethyl-butanoic acid Openeye Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-ethyl-butanoic acid CAS Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]-2-ethylbutanoic acid IUPAC Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]-2-ethylbutanoic acid Traditional Name: 4-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]-2-ethyl-butyric acid Formula: C23H26BrNO3 MolecularWeight: 444.36144

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Br)C)C(=O)O

Isomeric SMILES

CCC(CCC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Br)C)C(=O)O

InChI

InChI=1S/C23H26BrNO3/c1-4-17(23(26)27)7-11-20-15(2)25(14-16-5-8-18(24)9-6-16)22-12-10-19(28-3)13-21(20)22/h5-6,8-10,12-13,17H,4,7,11,14H2,1-3H3,(H,26,27)