3-[3-azanyl-4-(4-methylpiperidin-1-yl)phenyl]propyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: 3-[3-azanyl-4-(4-methylpiperidin-1-yl)phenyl]propyl-(pyridin-4-ylmethyl)azanium Openeye Name: 3-[3-amino-4-(4-methyl-1-piperidyl)phenyl]propyl-(4-pyridylmethyl)ammonium CAS Name: 3-[3-amino-4-(4-methyl-1-piperidinyl)phenyl]propyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: 3-[3-amino-4-(4-methylpiperidin-1-yl)phenyl]propyl-(pyridin-4-ylmethyl)azanium Traditional Name: 3-[3-amino-4-(4-methylpiperidino)phenyl]propyl-(4-pyridylmethyl)ammonium Formula: C21H31N4+ MolecularWeight: 339.49764

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)CCC[NH2+]CC3=CC=NC=C3)N

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)CCC[NH2+]CC3=CC=NC=C3)N

InChI

InChI=1S/C21H30N4/c1-17-8-13-25(14-9-17)21-5-4-18(15-20(21)22)3-2-10-24-16-19-6-11-23-12-7-19/h4-7,11-12,15,17,24H,2-3,8-10,13-14,16,22H2,1H3/p+1