N-[2-(2-adamantylidene)ethyl]-4-methyl-N-(3-oxidanylpropyl)benzenesulfonamide

Systemtic Name: N-[2-(2-adamantylidene)ethyl]-4-methyl-N-(3-oxidanylpropyl)benzenesulfonamide Openeye Name: N-[2-(2-adamantylidene)ethyl]-N-(3-hydroxypropyl)-4-methyl-benzenesulfonamide CAS Name: N-[2-(2-adamantylidene)ethyl]-N-(3-hydroxypropyl)-4-methylbenzenesulfonamide IUPAC Name: N-[2-(2-adamantylidene)ethyl]-N-(3-hydroxypropyl)-4-methylbenzenesulfonamide Traditional Name: N-[2-(2-adamantylidene)ethyl]-N-(3-hydroxypropyl)-4-methyl-benzenesulfonamide Formula: C22H31NO3S MolecularWeight: 389.55144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCO)CC=C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCO)CC=C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C22H31NO3S/c1-16-3-5-21(6-4-16)27(25,26)23(8-2-10-24)9-7-22-19-12-17-11-18(14-19)15-20(22)13-17/h3-7,17-20,24H,2,8-15H2,1H3