methyl 4-(6-ethylsulfonylhexylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylate

Systemtic Name: methyl 4-(6-ethylsulfonylhexylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylate Openeye Name: methyl 4-(6-ethylsulfonylhexylamino)-2,2-dimethyl-chromane-6-carboxylate CAS Name: 4-(6-ethylsulfonylhexylamino)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid methyl ester IUPAC Name: methyl 4-(6-ethylsulfonylhexylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylate Traditional Name: 4-(6-esylhexylamino)-2,2-dimethyl-chroman-6-carboxylic acid methyl ester Formula: C21H33NO5S MolecularWeight: 411.55542

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCCCCCNC1CC(OC2=C1C=C(C=C2)C(=O)OC)(C)C

Isomeric SMILES

CCS(=O)(=O)CCCCCCNC1CC(OC2=C1C=C(C=C2)C(=O)OC)(C)C

InChI

InChI=1S/C21H33NO5S/c1-5-28(24,25)13-9-7-6-8-12-22-18-15-21(2,3)27-19-11-10-16(14-17(18)19)20(23)26-4/h10-11,14,18,22H,5-9,12-13,15H2,1-4H3