7-[4-(4-methoxyphenoxy)phenyl]-1,4-thiazepan-5-one

Systemtic Name: 7-[4-(4-methoxyphenoxy)phenyl]-1,4-thiazepan-5-one Openeye Name: 7-[4-(4-methoxyphenoxy)phenyl]-1,4-thiazepan-5-one CAS Name: 7-[4-(4-methoxyphenoxy)phenyl]-1,4-thiazepan-5-one IUPAC Name: 7-[4-(4-methoxyphenoxy)phenyl]-1,4-thiazepan-5-one Traditional Name: 7-[4-(4-methoxyphenoxy)phenyl]-1,4-thiazepan-5-one Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=CC=C(C=C2)C3CC(=O)NCCS3

Isomeric SMILES

COC1=CC=C(C=C1)OC2=CC=C(C=C2)C3CC(=O)NCCS3

InChI

InChI=1S/C18H19NO3S/c1-21-14-6-8-16(9-7-14)22-15-4-2-13(3-5-15)17-12-18(20)19-10-11-23-17/h2-9,17H,10-12H2,1H3,(H,19,20)