[2-(1-methyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-(1-methyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-(1-methyl-2-phenyl-indol-3-yl)-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-(1-methyl-2-phenyl-3-indolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-methyl-2-phenylindol-3-yl)-2-oxoethyl] butanoate Traditional Name: butyric acid [2-keto-2-(1-methyl-2-phenyl-indol-3-yl)ethyl] ester Formula: C21H21NO3 MolecularWeight: 335.39634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)C1=C(N(C2=CC=CC=C21)C)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)OCC(=O)C1=C(N(C2=CC=CC=C21)C)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO3/c1-3-9-19(24)25-14-18(23)20-16-12-7-8-13-17(16)22(2)21(20)15-10-5-4-6-11-15/h4-8,10-13H,3,9,14H2,1-2H3