[2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate

Systemtic Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate Openeye Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxo-ethyl] 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [2-[1-(4-bromophenyl)ethylamino]-2-keto-ethyl] ester Formula: C22H23BrN2O3 MolecularWeight: 443.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)COC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=O)COC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C22H23BrN2O3/c1-15(16-9-11-18(23)12-10-16)25-21(26)14-28-22(27)8-4-5-17-13-24-20-7-3-2-6-19(17)20/h2-3,6-7,9-13,15,24H,4-5,8,14H2,1H3,(H,25,26)