[2-methyl-5-oxidanyl-1-(3-phenylprop-2-ynoyl)indol-3-yl] ethanoate

Systemtic Name: [2-methyl-5-oxidanyl-1-(3-phenylprop-2-ynoyl)indol-3-yl] ethanoate Openeye Name: [5-hydroxy-2-methyl-1-(3-phenylprop-2-ynoyl)indol-3-yl] acetate CAS Name: acetic acid [5-hydroxy-2-methyl-1-(1-oxo-3-phenylprop-2-ynyl)-3-indolyl] ester IUPAC Name: [5-hydroxy-2-methyl-1-(3-phenylprop-2-ynoyl)indol-3-yl] acetate Traditional Name: acetic acid [5-hydroxy-2-methyl-1-(3-phenylpropioloyl)indol-3-yl] ester Formula: C20H15NO4 MolecularWeight: 333.3374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C#CC3=CC=CC=C3)C=CC(=C2)O)OC(=O)C

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C#CC3=CC=CC=C3)C=CC(=C2)O)OC(=O)C

InChI

InChI=1S/C20H15NO4/c1-13-20(25-14(2)22)17-12-16(23)9-10-18(17)21(13)19(24)11-8-15-6-4-3-5-7-15/h3-7,9-10,12,23H,1-2H3