2-(4-methoxyphenyl)-2-oxidanyl-3,5-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 2-(4-methoxyphenyl)-2-oxidanyl-3,5-dihydro-1,5-benzothiazepin-4-one Openeye Name: 2-hydroxy-2-(4-methoxyphenyl)-3,5-dihydro-1,5-benzothiazepin-4-one CAS Name: 2-hydroxy-2-(4-methoxyphenyl)-3,5-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 2-hydroxy-2-(4-methoxyphenyl)-3,5-dihydro-1,5-benzothiazepin-4-one Traditional Name: 2-hydroxy-2-(4-methoxyphenyl)-3,5-dihydro-1,5-benzothiazepin-4-one Formula: C16H15NO3S MolecularWeight: 301.3602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC(=O)NC3=CC=CC=C3S2)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC(=O)NC3=CC=CC=C3S2)O

InChI

InChI=1S/C16H15NO3S/c1-20-12-8-6-11(7-9-12)16(19)10-15(18)17-13-4-2-3-5-14(13)21-16/h2-9,19H,10H2,1H3,(H,17,18)