(4R)-4-heptyl-5-(4-methylphenyl)sulfonyl-1,5-diazocan-2-one

Systemtic Name: (4R)-4-heptyl-5-(4-methylphenyl)sulfonyl-1,5-diazocan-2-one Openeye Name: (4R)-4-heptyl-5-(p-tolylsulfonyl)-1,5-diazocan-2-one CAS Name: (4R)-4-heptyl-5-(4-methylphenyl)sulfonyl-1,5-diazocan-2-one IUPAC Name: (4R)-4-heptyl-5-(4-methylphenyl)sulfonyl-1,5-diazocan-2-one Traditional Name: (4R)-4-heptyl-5-tosyl-1,5-diazocan-2-one Formula: C20H32N2O3S MolecularWeight: 380.54468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CC(=O)NCCCN1S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCC[C@@H]1CC(=O)NCCCN1S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H32N2O3S/c1-3-4-5-6-7-9-18-16-20(23)21-14-8-15-22(18)26(24,25)19-12-10-17(2)11-13-19/h10-13,18H,3-9,14-16H2,1-2H3,(H,21,23)/t18-/m1/s1