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

Systemtic Name: 4-[1-(4-bromophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]butanoic acid Openeye Name: 4-[1-(4-bromobenzoyl)-5-methoxy-2-methyl-indol-3-yl]butanoic acid CAS Name: 4-[1-[(4-bromophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]butanoic acid IUPAC Name: 4-[1-(4-bromobenzoyl)-5-methoxy-2-methylindol-3-yl]butanoic acid Traditional Name: 4-[1-(4-bromobenzoyl)-5-methoxy-2-methyl-indol-3-yl]butyric acid Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Br)C=CC(=C2)OC)CCCC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Br)C=CC(=C2)OC)CCCC(=O)O

InChI

InChI=1S/C21H20BrNO4/c1-13-17(4-3-5-20(24)25)18-12-16(27-2)10-11-19(18)23(13)21(26)14-6-8-15(22)9-7-14/h6-12H,3-5H2,1-2H3,(H,24,25)