N-[[4-[3-(heptylamino)-2-oxidanyl-propoxy]-3-methoxy-phenyl]methyl]nonanamide

Systemtic Name: N-[[4-[3-(heptylamino)-2-oxidanyl-propoxy]-3-methoxy-phenyl]methyl]nonanamide Openeye Name: N-[[4-[3-(heptylamino)-2-hydroxy-propoxy]-3-methoxy-phenyl]methyl]nonanamide CAS Name: N-[[4-[3-(heptylamino)-2-hydroxypropoxy]-3-methoxyphenyl]methyl]nonanamide IUPAC Name: N-[[4-[3-(heptylamino)-2-hydroxypropoxy]-3-methoxyphenyl]methyl]nonanamide Traditional Name: N-[4-[3-(heptylamino)-2-hydroxy-propoxy]-3-methoxy-benzyl]pelargonamide Formula: C27H48N2O4 MolecularWeight: 464.68102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NCC1=CC(=C(C=C1)OCC(CNCCCCCCC)O)OC

Isomeric SMILES

CCCCCCCCC(=O)NCC1=CC(=C(C=C1)OCC(CNCCCCCCC)O)OC

InChI

InChI=1S/C27H48N2O4/c1-4-6-8-10-11-13-15-27(31)29-20-23-16-17-25(26(19-23)32-3)33-22-24(30)21-28-18-14-12-9-7-5-2/h16-17,19,24,28,30H,4-15,18,20-22H2,1-3H3,(H,29,31)