methyl 4-(5-ethylsulfonylpentylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylate

Systemtic Name: methyl 4-(5-ethylsulfonylpentylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylate Openeye Name: methyl 4-(5-ethylsulfonylpentylamino)-2,2-dimethyl-chromane-6-carboxylate CAS Name: 4-(5-ethylsulfonylpentylamino)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-ethylsulfonylpentylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylate Traditional Name: 4-(5-esylpentylamino)-2,2-dimethyl-chroman-6-carboxylic acid methyl ester Formula: C20H31NO5S MolecularWeight: 397.52884

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCCCCNC1CC(OC2=C1C=C(C=C2)C(=O)OC)(C)C

Isomeric SMILES

CCS(=O)(=O)CCCCCNC1CC(OC2=C1C=C(C=C2)C(=O)OC)(C)C

InChI

InChI=1S/C20H31NO5S/c1-5-27(23,24)12-8-6-7-11-21-17-14-20(2,3)26-18-10-9-15(13-16(17)18)19(22)25-4/h9-10,13,17,21H,5-8,11-12,14H2,1-4H3