[4-(dibutylamino)-2-(heptan-3-yloxymethylamino)phenyl]iminoazanium

Systemtic Name: [4-(dibutylamino)-2-(heptan-3-yloxymethylamino)phenyl]iminoazanium Openeye Name: [4-(dibutylamino)-2-(1-ethylpentoxymethylamino)phenyl]iminoammonium CAS Name: [4-(dibutylamino)-2-(heptan-3-yloxymethylamino)phenyl]iminoammonium IUPAC Name: [4-(dibutylamino)-2-(heptan-3-yloxymethylamino)phenyl]iminoazanium Traditional Name: [4-(dibutylamino)-2-(1-ethylpentoxymethylamino)phenyl]iminoammonium Formula: C22H41N4O+ MolecularWeight: 377.58714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)OCNC1=C(C=CC(=C1)N(CCCC)CCCC)N=[NH2+]

Isomeric SMILES

CCCCC(CC)OCNC1=C(C=CC(=C1)N(CCCC)CCCC)N=[NH2+]

InChI

InChI=1S/C22H40N4O/c1-5-9-12-20(8-4)27-18-24-22-17-19(13-14-21(22)25-23)26(15-10-6-2)16-11-7-3/h13-14,17,20,23-24H,5-12,15-16,18H2,1-4H3/p+1