methyl 2,6-dimethyl-4-[4-(3-phenylprop-2-ynoxy)phenyl]sulfonyl-morpholine-3-carboxylate

Systemtic Name: methyl 2,6-dimethyl-4-[4-(3-phenylprop-2-ynoxy)phenyl]sulfonyl-morpholine-3-carboxylate Openeye Name: methyl 2,6-dimethyl-4-[4-(3-phenylprop-2-ynoxy)phenyl]sulfonyl-morpholine-3-carboxylate CAS Name: 2,6-dimethyl-4-[4-(3-phenylprop-2-ynoxy)phenyl]sulfonyl-3-morpholinecarboxylic acid methyl ester IUPAC Name: methyl 2,6-dimethyl-4-[4-(3-phenylprop-2-ynoxy)phenyl]sulfonylmorpholine-3-carboxylate Traditional Name: 2,6-dimethyl-4-[4-(3-phenylprop-2-ynoxy)phenyl]sulfonyl-morpholine-3-carboxylic acid methyl ester Formula: C23H25NO6S MolecularWeight: 443.5127

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(C(O1)C)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)OCC#CC3=CC=CC=C3

Isomeric SMILES

CC1CN(C(C(O1)C)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)OCC#CC3=CC=CC=C3

InChI

InChI=1S/C23H25NO6S/c1-17-16-24(22(18(2)30-17)23(25)28-3)31(26,27)21-13-11-20(12-14-21)29-15-7-10-19-8-5-4-6-9-19/h4-6,8-9,11-14,17-18,22H,15-16H2,1-3H3