2-(3-azanylpropyl)-1-(3-methylbutyl)-3-(4-pentoxyphenyl)guanidine

Systemtic Name: 2-(3-azanylpropyl)-1-(3-methylbutyl)-3-(4-pentoxyphenyl)guanidine Openeye Name: 2-(3-aminopropyl)-1-isopentyl-3-(4-pentoxyphenyl)guanidine CAS Name: 2-(3-aminopropyl)-1-(3-methylbutyl)-3-(4-pentoxyphenyl)guanidine IUPAC Name: 2-(3-aminopropyl)-1-(3-methylbutyl)-3-(4-pentoxyphenyl)guanidine Traditional Name: 2-(3-aminopropyl)-1-(4-amoxyphenyl)-3-isoamyl-guanidine Formula: C20H36N4O MolecularWeight: 348.52604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=NCCCN)NCCC(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=NCCCN)NCCC(C)C

InChI

InChI=1S/C20H36N4O/c1-4-5-6-16-25-19-10-8-18(9-11-19)24-20(22-14-7-13-21)23-15-12-17(2)3/h8-11,17H,4-7,12-16,21H2,1-3H3,(H2,22,23,24)