7-(4-methylphenyl)sulfonyl-1-oxa-7-azacyclotridec-8-yn-13-one

Systemtic Name: 7-(4-methylphenyl)sulfonyl-1-oxa-7-azacyclotridec-8-yn-13-one Openeye Name: 7-(p-tolylsulfonyl)-1-oxa-7-azacyclotridec-8-yn-13-one CAS Name: 7-(4-methylphenyl)sulfonyl-1-oxa-7-azacyclotridec-8-yn-13-one IUPAC Name: 7-(4-methylphenyl)sulfonyl-1-oxa-7-azacyclotridec-8-yn-13-one Traditional Name: 7-tosyl-1-oxa-7-azacyclotridec-8-yn-13-one Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCOC(=O)CCCC#C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCOC(=O)CCCC#C2

InChI

InChI=1S/C18H23NO4S/c1-16-9-11-17(12-10-16)24(21,22)19-13-5-2-4-8-18(20)23-15-7-3-6-14-19/h9-12H,2-4,6-8,14-15H2,1H3