(8E,12Z)-14-methylidene-4-(4-methylphenyl)sulfonyl-1-oxa-4-azacyclopentadeca-8,12-dien-2-one

Systemtic Name: (8E,12Z)-14-methylidene-4-(4-methylphenyl)sulfonyl-1-oxa-4-azacyclopentadeca-8,12-dien-2-one Openeye Name: (8E,12Z)-14-methylene-4-(p-tolylsulfonyl)-1-oxa-4-azacyclopentadeca-8,12-dien-2-one CAS Name: (8E,12Z)-14-methylene-4-(4-methylphenyl)sulfonyl-1-oxa-4-azacyclopentadeca-8,12-dien-2-one IUPAC Name: (8E,12Z)-14-methylidene-4-(4-methylphenyl)sulfonyl-1-oxa-4-azacyclopentadeca-8,12-dien-2-one Traditional Name: (8E,12Z)-14-methylene-4-tosyl-1-oxa-4-azacyclopentadeca-8,12-dien-2-one Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC=CCCC=CC(=C)COC(=O)C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC/C=C/CC/C=C\C(=C)COC(=O)C2

InChI

InChI=1S/C21H27NO4S/c1-18-11-13-20(14-12-18)27(24,25)22-15-9-7-5-3-4-6-8-10-19(2)17-26-21(23)16-22/h3,5,8,10-14H,2,4,6-7,9,15-17H2,1H3/b5-3+,10-8-