3-[2-(4-bromophenyl)-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindol-1-yl]propanoic acid

Systemtic Name: 3-[2-(4-bromophenyl)-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindol-1-yl]propanoic acid Openeye Name: 3-[2-(4-bromophenyl)-6,6-dimethyl-4-oxo-5,7-dihydroindol-1-yl]propanoic acid CAS Name: 3-[2-(4-bromophenyl)-6,6-dimethyl-4-oxo-5,7-dihydroindol-1-yl]propanoic acid IUPAC Name: 3-[2-(4-bromophenyl)-6,6-dimethyl-4-oxo-5,7-dihydroindol-1-yl]propanoic acid Traditional Name: 3-[2-(4-bromophenyl)-4-keto-6,6-dimethyl-5,7-dihydroindol-1-yl]propionic acid Formula: C19H20BrNO3 MolecularWeight: 390.271

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(N2CCC(=O)O)C3=CC=C(C=C3)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=C(N2CCC(=O)O)C3=CC=C(C=C3)Br)C(=O)C1)C

InChI

InChI=1S/C19H20BrNO3/c1-19(2)10-16-14(17(22)11-19)9-15(21(16)8-7-18(23)24)12-3-5-13(20)6-4-12/h3-6,9H,7-8,10-11H2,1-2H3,(H,23,24)