[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl] 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic acid [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid [2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl] ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H21NO5/c1-2-15-4-3-5-16-17(11-23-22(15)16)18(24)12-26-21(25)9-7-14-6-8-19-20(10-14)28-13-27-19/h3-6,8,10-11,23H,2,7,9,12-13H2,1H3