2-[1-[2-(4-bromophenyl)ethyl]-5-prop-2-enoxy-indol-3-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[1-[2-(4-bromophenyl)ethyl]-5-prop-2-enoxy-indol-3-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[5-allyloxy-1-[2-(4-bromophenyl)ethyl]indol-3-yl]-2-oxo-acetic acid CAS Name: 2-[1-[2-(4-bromophenyl)ethyl]-5-prop-2-enoxy-3-indolyl]-2-oxoacetic acid IUPAC Name: 2-[1-[2-(4-bromophenyl)ethyl]-5-prop-2-enoxyindol-3-yl]-2-oxoacetic acid Traditional Name: 2-[5-allyloxy-1-[2-(4-bromophenyl)ethyl]indol-3-yl]-2-keto-acetic acid Formula: C21H18BrNO4 MolecularWeight: 428.27592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC2=C(C=C1)N(C=C2C(=O)C(=O)O)CCC3=CC=C(C=C3)Br

Isomeric SMILES

C=CCOC1=CC2=C(C=C1)N(C=C2C(=O)C(=O)O)CCC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrNO4/c1-2-11-27-16-7-8-19-17(12-16)18(20(24)21(25)26)13-23(19)10-9-14-3-5-15(22)6-4-14/h2-8,12-13H,1,9-11H2,(H,25,26)