(2S,3'R)-3'-(4-chlorophenyl)spiro[1-benzofuran-2,2'-3,4-dihydro-1,4-benzothiazine]-3-one

Systemtic Name: (2S,3'R)-3'-(4-chlorophenyl)spiro[1-benzofuran-2,2'-3,4-dihydro-1,4-benzothiazine]-3-one Openeye Name: (2S,3R)-3-(4-chlorophenyl)spiro[3,4-dihydro-1,4-benzothiazine-2,2'-benzofuran]-3'-one CAS Name: (2S,3R)-3-(4-chlorophenyl)-3'-spiro[3,4-dihydro-1,4-benzothiazine-2,2'-benzofuran]one IUPAC Name: (2S,3'R)-3'-(4-chlorophenyl)spiro[1-benzofuran-2,2'-3,4-dihydro-1,4-benzothiazine]-3-one Traditional Name: (2S,3R)-3-(4-chlorophenyl)spiro[3,4-dihydro-1,4-benzothiazine-2,2'-coumaran]-3'-one Formula: C21H14ClNO2S MolecularWeight: 379.85936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3(O2)C(NC4=CC=CC=C4S3)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)[C@]3(O2)[C@H](NC4=CC=CC=C4S3)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C21H14ClNO2S/c22-14-11-9-13(10-12-14)19-21(26-18-8-4-2-6-16(18)23-19)20(24)15-5-1-3-7-17(15)25-21/h1-12,19,23H/t19-,21+/m1/s1