4-[ethyl-(phenylmethyl)amino]butyl 6-fluoranyl-3-oxidanylidene-1,2-dihydroindene-2-carboxylate

Systemtic Name: 4-[ethyl-(phenylmethyl)amino]butyl 6-fluoranyl-3-oxidanylidene-1,2-dihydroindene-2-carboxylate Openeye Name: 4-[benzyl(ethyl)amino]butyl 5-fluoro-1-oxo-indane-2-carboxylate CAS Name: 6-fluoro-3-oxo-1,2-dihydroindene-2-carboxylic acid 4-[ethyl-(phenylmethyl)amino]butyl ester IUPAC Name: 4-[benzyl(ethyl)amino]butyl 6-fluoro-3-oxo-1,2-dihydroindene-2-carboxylate Traditional Name: 5-fluoro-1-keto-indane-2-carboxylic acid 4-[benzyl(ethyl)amino]butyl ester Formula: C23H26FNO3 MolecularWeight: 383.455843

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCOC(=O)C1CC2=C(C1=O)C=CC(=C2)F)CC3=CC=CC=C3

Isomeric SMILES

CCN(CCCCOC(=O)C1CC2=C(C1=O)C=CC(=C2)F)CC3=CC=CC=C3

InChI

InChI=1S/C23H26FNO3/c1-2-25(16-17-8-4-3-5-9-17)12-6-7-13-28-23(27)21-15-18-14-19(24)10-11-20(18)22(21)26/h3-5,8-11,14,21H,2,6-7,12-13,15-16H2,1H3