2-[2-(3-bromophenyl)-5-butan-2-yl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3-bromophenyl)-5-butan-2-yl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3-bromophenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3-bromophenyl)-5-butan-2-yl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3-bromophenyl)-5-butan-2-yl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3-bromophenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid Formula: C20H20BrNO2 MolecularWeight: 386.2823

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H20BrNO2/c1-3-12(2)13-7-8-18-16(10-13)17(11-19(23)24)20(22-18)14-5-4-6-15(21)9-14/h4-10,12,22H,3,11H2,1-2H3,(H,23,24)