N-[[4-(2-azanylethoxy)-3-methoxy-phenyl]methyl]octadec-9-ynamide

Systemtic Name: N-[[4-(2-azanylethoxy)-3-methoxy-phenyl]methyl]octadec-9-ynamide Openeye Name: N-[[4-(2-aminoethoxy)-3-methoxy-phenyl]methyl]octadec-9-ynamide CAS Name: N-[[4-(2-aminoethoxy)-3-methoxyphenyl]methyl]-9-octadecynamide IUPAC Name: N-[[4-(2-aminoethoxy)-3-methoxyphenyl]methyl]octadec-9-ynamide Traditional Name: N-[4-(2-aminoethoxy)-3-methoxy-benzyl]octadec-9-ynamide Formula: C28H46N2O3 MolecularWeight: 458.67644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CCCCCCCCC(=O)NCC1=CC(=C(C=C1)OCCN)OC

Isomeric SMILES

CCCCCCCCC#CCCCCCCCC(=O)NCC1=CC(=C(C=C1)OCCN)OC

InChI

InChI=1S/C28H46N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28(31)30-24-25-19-20-26(33-22-21-29)27(23-25)32-2/h19-20,23H,3-9,12-18,21-22,24,29H2,1-2H3,(H,30,31)