methyl 4-[2-(butylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]-4-oxidanylidene-3-phenyl-butanoate

Systemtic Name: methyl 4-[2-(butylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]-4-oxidanylidene-3-phenyl-butanoate Openeye Name: methyl 4-[2-(butylsulfonylamino)indan-5-yl]-4-oxo-3-phenyl-butanoate CAS Name: 4-[2-(butylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]-4-oxo-3-phenylbutanoic acid methyl ester IUPAC Name: methyl 4-[2-(butylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]-4-oxo-3-phenylbutanoate Traditional Name: 4-[2-(butylsulfonylamino)indan-5-yl]-4-keto-3-phenyl-butyric acid methyl ester Formula: C24H29NO5S MolecularWeight: 443.55576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1CC2=C(C1)C=C(C=C2)C(=O)C(CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CCCCS(=O)(=O)NC1CC2=C(C1)C=C(C=C2)C(=O)C(CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H29NO5S/c1-3-4-12-31(28,29)25-21-14-18-10-11-19(13-20(18)15-21)24(27)22(16-23(26)30-2)17-8-6-5-7-9-17/h5-11,13,21-22,25H,3-4,12,14-16H2,1-2H3