1-[4-(2-azanylethoxy)-3-methoxy-phenyl]-N-[(E)-octadec-9-enyl]methanesulfonamide

Systemtic Name: 1-[4-(2-azanylethoxy)-3-methoxy-phenyl]-N-[(E)-octadec-9-enyl]methanesulfonamide Openeye Name: 1-[4-(2-aminoethoxy)-3-methoxy-phenyl]-N-[(E)-octadec-9-enyl]methanesulfonamide CAS Name: 1-[4-(2-aminoethoxy)-3-methoxyphenyl]-N-[(E)-octadec-9-enyl]methanesulfonamide IUPAC Name: 1-[4-(2-aminoethoxy)-3-methoxyphenyl]-N-[(E)-octadec-9-enyl]methanesulfonamide Traditional Name: 1-[4-(2-aminoethoxy)-3-methoxy-phenyl]-N-[(E)-octadec-9-enyl]methanesulfonamide Formula: C28H50N2O4S MolecularWeight: 510.7726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNS(=O)(=O)CC1=CC(=C(C=C1)OCCN)OC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNS(=O)(=O)CC1=CC(=C(C=C1)OCCN)OC

InChI

InChI=1S/C28H50N2O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-30-35(31,32)25-26-19-20-27(34-23-21-29)28(24-26)33-2/h10-11,19-20,24,30H,3-9,12-18,21-23,25,29H2,1-2H3/b11-10+