N-[(3R,4S)-2,2-dimethyl-3-oxidanyl-4-(phenethylamino)-3,4-dihydrochromen-7-yl]-N-propan-2-yl-methanesulfonamide

Systemtic Name: N-[(3R,4S)-2,2-dimethyl-3-oxidanyl-4-(phenethylamino)-3,4-dihydrochromen-7-yl]-N-propan-2-yl-methanesulfonamide Openeye Name: N-[(3R,4S)-3-hydroxy-2,2-dimethyl-4-(phenethylamino)chroman-7-yl]-N-isopropyl-methanesulfonamide CAS Name: N-[(3R,4S)-3-hydroxy-2,2-dimethyl-4-(phenethylamino)-3,4-dihydro-2H-1-benzopyran-7-yl]-N-propan-2-ylmethanesulfonamide IUPAC Name: N-[(3R,4S)-3-hydroxy-2,2-dimethyl-4-(phenethylamino)-3,4-dihydrochromen-7-yl]-N-propan-2-ylmethanesulfonamide Traditional Name: N-[(3R,4S)-3-hydroxy-2,2-dimethyl-4-(phenethylamino)chroman-7-yl]-N-isopropyl-methanesulfonamide Formula: C23H32N2O4S MolecularWeight: 432.57618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC2=C(C=C1)C(C(C(O2)(C)C)O)NCCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)N(C1=CC2=C(C=C1)[C@@H]([C@H](C(O2)(C)C)O)NCCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H32N2O4S/c1-16(2)25(30(5,27)28)18-11-12-19-20(15-18)29-23(3,4)22(26)21(19)24-14-13-17-9-7-6-8-10-17/h6-12,15-16,21-22,24,26H,13-14H2,1-5H3/t21-,22+/m0/s1