(7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) (2S)-2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) (2S)-2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (7-fluoro-1-methyl-3-oxo-indan-4-yl) (2S)-2-[(2-ethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-ethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-ethoxybenzoyl)amino]-3-methyl-butyric acid (7-fluoro-3-keto-1-methyl-indan-4-yl) ester Formula: C24H26FNO5 MolecularWeight: 427.465343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OC2=C3C(=O)CC(C3=C(C=C2)F)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)OC2=C3C(=O)CC(C3=C(C=C2)F)C

InChI

InChI=1S/C24H26FNO5/c1-5-30-18-9-7-6-8-15(18)23(28)26-22(13(2)3)24(29)31-19-11-10-16(25)20-14(4)12-17(27)21(19)20/h6-11,13-14,22H,5,12H2,1-4H3,(H,26,28)/t14?,22-/m0/s1