[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl] 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)OCC(=O)NCCC2=CNC3=CC=CC=C32)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)OCC(=O)NCCC2=CNC3=CC=CC=C32)OC

InChI

InChI=1S/C23H26N2O5/c1-28-18-11-16(12-19(13-18)29-2)7-8-23(27)30-15-22(26)24-10-9-17-14-25-21-6-4-3-5-20(17)21/h3-6,11-14,25H,7-10,15H2,1-2H3,(H,24,26)