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

Systemtic Name: ethyl 2-[4-[ethyl-(phenylmethyl)amino]butyl]-6-fluoranyl-3-oxidanylidene-1H-indene-2-carboxylate Openeye Name: ethyl 2-[4-[benzyl(ethyl)amino]butyl]-5-fluoro-1-oxo-indane-2-carboxylate CAS Name: 2-[4-[ethyl-(phenylmethyl)amino]butyl]-6-fluoro-3-oxo-1H-indene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[benzyl(ethyl)amino]butyl]-6-fluoro-3-oxo-1H-indene-2-carboxylate Traditional Name: 2-[4-[benzyl(ethyl)amino]butyl]-5-fluoro-1-keto-indane-2-carboxylic acid ethyl ester Formula: C25H30FNO3 MolecularWeight: 411.509003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCC1(CC2=C(C1=O)C=CC(=C2)F)C(=O)OCC)CC3=CC=CC=C3

Isomeric SMILES

CCN(CCCCC1(CC2=C(C1=O)C=CC(=C2)F)C(=O)OCC)CC3=CC=CC=C3

InChI

InChI=1S/C25H30FNO3/c1-3-27(18-19-10-6-5-7-11-19)15-9-8-14-25(24(29)30-4-2)17-20-16-21(26)12-13-22(20)23(25)28/h5-7,10-13,16H,3-4,8-9,14-15,17-18H2,1-2H3