2,3-dihydro-1H-inden-5-yl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate

Systemtic Name: 2,3-dihydro-1H-inden-5-yl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Openeye Name: indan-5-yl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate CAS Name: 3-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]benzoic acid 2,3-dihydro-1H-inden-5-yl ester IUPAC Name: 2,3-dihydro-1H-inden-5-yl 3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoate Traditional Name: 3-[(2R,6R)-2,6-dimethylmorpholino]sulfonylbenzoic acid indan-5-yl ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC4=C(CCC4)C=C3

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H25NO5S/c1-15-13-23(14-16(2)27-15)29(25,26)21-8-4-7-19(12-21)22(24)28-20-10-9-17-5-3-6-18(17)11-20/h4,7-12,15-16H,3,5-6,13-14H2,1-2H3/t15-,16-/m1/s1