3-[(5Z)-5-(3-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,4-thiazepan-7-yl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(5Z)-5-(3-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,4-thiazepan-7-yl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 2-hydroxy-3-[(5Z)-5-(3-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1,4-thiazepan-7-yl]-6-methyl-pyran-4-one CAS Name: 2-hydroxy-3-[(5Z)-5-(3-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-1,4-thiazepan-7-yl]-6-methyl-4-pyranone IUPAC Name: 2-hydroxy-3-[(5Z)-5-(3-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-1,4-thiazepan-7-yl]-6-methylpyran-4-one Traditional Name: 2-hydroxy-3-[(5Z)-5-(6-keto-3-methoxy-cyclohexa-2,4-dien-1-ylidene)-1,4-thiazepan-7-yl]-6-methyl-pyran-4-one Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C2CC(=C3C=C(C=CC3=O)OC)NCCS2

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C2C/C(=C/3\C=C(C=CC3=O)OC)/NCCS2

InChI

InChI=1S/C18H19NO5S/c1-10-7-15(21)17(18(22)24-10)16-9-13(19-5-6-25-16)12-8-11(23-2)3-4-14(12)20/h3-4,7-8,16,19,22H,5-6,9H2,1-2H3/b13-12-