[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 3-methyl-2-(thiophene-2-carbonylamino)butanoate CAS Name: 3-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 3-methyl-2-(thiophene-2-carbonylamino)butanoate Traditional Name: 3-methyl-2-(2-thenoylamino)butyric acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC2=C(CCC2)C=C1)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)C1=CC2=C(CCC2)C=C1)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H23NO4S/c1-13(2)19(22-20(24)18-7-4-10-27-18)21(25)26-12-17(23)16-9-8-14-5-3-6-15(14)11-16/h4,7-11,13,19H,3,5-6,12H2,1-2H3,(H,22,24)