(2-methylphenyl) 3-[1-(4-bromophenyl)carbonylindol-3-yl]propanoate

Systemtic Name: (2-methylphenyl) 3-[1-(4-bromophenyl)carbonylindol-3-yl]propanoate Openeye Name: o-tolyl 3-[1-(4-bromobenzoyl)indol-3-yl]propanoate CAS Name: 3-[1-[(4-bromophenyl)-oxomethyl]-3-indolyl]propanoic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 3-[1-(4-bromobenzoyl)indol-3-yl]propanoate Traditional Name: 3-[1-(4-bromobenzoyl)indol-3-yl]propionic acid o-tolyl ester Formula: C25H20BrNO3 MolecularWeight: 462.3352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)CCC2=CN(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1OC(=O)CCC2=CN(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H20BrNO3/c1-17-6-2-5-9-23(17)30-24(28)15-12-19-16-27(22-8-4-3-7-21(19)22)25(29)18-10-13-20(26)14-11-18/h2-11,13-14,16H,12,15H2,1H3