4-methyl-N-[(E)-2-(5-oxidanylnonan-5-yl)oct-1-enyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-methyl-N-[(E)-2-(5-oxidanylnonan-5-yl)oct-1-enyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-[(E)-2-(1-butyl-1-hydroxy-pentyl)oct-1-enyl]-4-methyl-benzenesulfonamide CAS Name: N-[(E)-2-(5-hydroxynonan-5-yl)oct-1-enyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-[(E)-2-(5-hydroxynonan-5-yl)oct-1-enyl]-4-methylbenzenesulfonamide Traditional Name: N-benzyl-N-[(E)-2-(1-butyl-1-hydroxy-pentyl)oct-1-enyl]-4-methyl-benzenesulfonamide Formula: C31H47NO3S MolecularWeight: 513.77478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C)C(CCCC)(CCCC)O

Isomeric SMILES

CCCCCC/C(=C\N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C)/C(CCCC)(CCCC)O

InChI

InChI=1S/C31H47NO3S/c1-5-8-11-15-18-29(31(33,23-9-6-2)24-10-7-3)26-32(25-28-16-13-12-14-17-28)36(34,35)30-21-19-27(4)20-22-30/h12-14,16-17,19-22,26,33H,5-11,15,18,23-25H2,1-4H3/b29-26+