(2R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-5-(3-methylbut-2-enyl)-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: (2R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-5-(3-methylbut-2-enyl)-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: (2R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-5-(3-methylbut-2-enyl)-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: (2R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-5-(3-methylbut-2-enyl)-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: (2R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-5-(3-methylbut-2-enyl)-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: (2R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-5-(3-methylbut-2-enyl)-3,4-dihydro-2H-1,5-benzothiazepine Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1CCC(SC2=C1C=CC(=C2)OC)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC(=CCN1CC[C@@H](SC2=C1C=CC(=C2)OC)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H25NO3S/c1-15(2)8-10-23-11-9-21(16-4-7-19-20(12-16)26-14-25-19)27-22-13-17(24-3)5-6-18(22)23/h4-8,12-13,21H,9-11,14H2,1-3H3/t21-/m1/s1