[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-(3,4-dimethylphenoxy)ethanoate

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-(3,4-dimethylphenoxy)ethanoate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 2-(3,4-dimethylphenoxy)acetate CAS Name: 2-(3,4-dimethylphenoxy)acetic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-(3,4-dimethylphenoxy)acetate Traditional Name: 2-(3,4-dimethylphenoxy)acetic acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)OC(C)C(=O)C2=CNC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)OC(C)C(=O)C2=CNC3=CC=CC=C32)C

InChI

InChI=1S/C21H21NO4/c1-13-8-9-16(10-14(13)2)25-12-20(23)26-15(3)21(24)18-11-22-19-7-5-4-6-17(18)19/h4-11,15,22H,12H2,1-3H3