[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] (2S)-2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] (2S)-2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) (2S)-2-[(2-ethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-ethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-ethoxybenzoyl)amino]-3-methyl-butyric acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C25H29NO5 MolecularWeight: 423.50146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C25H29NO5/c1-4-30-22-11-6-5-10-20(22)24(28)26-23(16(2)3)25(29)31-15-21(27)19-13-12-17-8-7-9-18(17)14-19/h5-6,10-14,16,23H,4,7-9,15H2,1-3H3,(H,26,28)/t23-/m0/s1