N3-ethyl-4-methoxy-N3-octadecyl-benzene-1,3-diamine

Systemtic Name: N3-ethyl-4-methoxy-N3-octadecyl-benzene-1,3-diamine Openeye Name: N3-ethyl-4-methoxy-N3-octadecyl-benzene-1,3-diamine CAS Name: N3-ethyl-4-methoxy-N3-octadecylbenzene-1,3-diamine IUPAC Name: 3-N-ethyl-4-methoxy-3-N-octadecylbenzene-1,3-diamine Traditional Name: (5-amino-2-methoxy-phenyl)-ethyl-stearyl-amine Formula: C27H50N2O MolecularWeight: 418.6987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CC)C1=C(C=CC(=C1)N)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CC)C1=C(C=CC(=C1)N)OC

InChI

InChI=1S/C27H50N2O/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-29(5-2)26-24-25(28)21-22-27(26)30-3/h21-22,24H,4-20,23,28H2,1-3H3