N-[(E,3S)-5-(hydroxymethyl)-2-methyl-hept-4-en-3-yl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[(E,3S)-5-(hydroxymethyl)-2-methyl-hept-4-en-3-yl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[(E,1S)-3-(hydroxymethyl)-1-isopropyl-pent-2-enyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[(E,3S)-5-(hydroxymethyl)-2-methylhept-4-en-3-yl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[(E,3S)-5-(hydroxymethyl)-2-methylhept-4-en-3-yl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[(E,1S)-1-isopropyl-3-methylol-pent-2-enyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C18H29NO3S MolecularWeight: 339.49276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC(C(C)C)NS(=O)(=O)C1=C(C=C(C=C1C)C)C)CO

Isomeric SMILES

CC/C(=C\[C@H](C(C)C)NS(=O)(=O)C1=C(C=C(C=C1C)C)C)/CO

InChI

InChI=1S/C18H29NO3S/c1-7-16(11-20)10-17(12(2)3)19-23(21,22)18-14(5)8-13(4)9-15(18)6/h8-10,12,17,19-20H,7,11H2,1-6H3/b16-10+/t17-/m1/s1