ethyl 4-(3-octanoylindol-1-yl)butanoate

Systemtic Name: ethyl 4-(3-octanoylindol-1-yl)butanoate Openeye Name: ethyl 4-(3-octanoylindol-1-yl)butanoate CAS Name: 4-[3-(1-oxooctyl)-1-indolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-(3-octanoylindol-1-yl)butanoate Traditional Name: 4-(3-caprylylindol-1-yl)butyric acid ethyl ester Formula: C22H31NO3 MolecularWeight: 357.48644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CN(C2=CC=CC=C21)CCCC(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)C1=CN(C2=CC=CC=C21)CCCC(=O)OCC

InChI

InChI=1S/C22H31NO3/c1-3-5-6-7-8-14-21(24)19-17-23(16-11-15-22(25)26-4-2)20-13-10-9-12-18(19)20/h9-10,12-13,17H,3-8,11,14-16H2,1-2H3