3-[3-(4-bromophenyl)-6-methyl-4-oxidanylidene-6,7-dihydro-5H-indol-1-yl]propanoic acid

Systemtic Name: 3-[3-(4-bromophenyl)-6-methyl-4-oxidanylidene-6,7-dihydro-5H-indol-1-yl]propanoic acid Openeye Name: 3-[3-(4-bromophenyl)-6-methyl-4-oxo-6,7-dihydro-5H-indol-1-yl]propanoic acid CAS Name: 3-[3-(4-bromophenyl)-6-methyl-4-oxo-6,7-dihydro-5H-indol-1-yl]propanoic acid IUPAC Name: 3-[3-(4-bromophenyl)-6-methyl-4-oxo-6,7-dihydro-5H-indol-1-yl]propanoic acid Traditional Name: 3-[3-(4-bromophenyl)-4-keto-6-methyl-6,7-dihydro-5H-indol-1-yl]propionic acid Formula: C18H18BrNO3 MolecularWeight: 376.24442

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(=O)C1)C(=CN2CCC(=O)O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1CC2=C(C(=O)C1)C(=CN2CCC(=O)O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrNO3/c1-11-8-15-18(16(21)9-11)14(10-20(15)7-6-17(22)23)12-2-4-13(19)5-3-12/h2-5,10-11H,6-9H2,1H3,(H,22,23)