(2R,3R)-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1H-benzo[g][1,5]benzothiazepin-4-one

Systemtic Name: (2R,3R)-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1H-benzo[g][1,5]benzothiazepin-4-one Openeye Name: (2R,3R)-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1H-benzo[g][1,5]benzothiazepin-4-one CAS Name: (2R,3R)-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1H-benzo[g][1,5]benzothiazepin-4-one IUPAC Name: (2R,3R)-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1H-benzo[g][1,5]benzothiazepin-4-one Traditional Name: (2R,3R)-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1H-benzo[g][1,5]benzothiazepin-4-one Formula: C20H17NO3S MolecularWeight: 351.41888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=O)SC3=C(N2)C4=CC=CC=C4C=C3)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H](C(=O)SC3=C(N2)C4=CC=CC=C4C=C3)O

InChI

InChI=1S/C20H17NO3S/c1-24-14-9-6-13(7-10-14)17-19(22)20(23)25-16-11-8-12-4-2-3-5-15(12)18(16)21-17/h2-11,17,19,21-22H,1H3/t17-,19-/m1/s1