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

Systemtic Name: 3-[3-azanyl-4-(4-methylpiperidin-1-yl)phenyl]propyl-(phenylmethyl)azanium Openeye Name: 3-[3-amino-4-(4-methyl-1-piperidyl)phenyl]propyl-benzyl-ammonium CAS Name: 3-[3-amino-4-(4-methyl-1-piperidinyl)phenyl]propyl-(phenylmethyl)ammonium IUPAC Name: 3-[3-amino-4-(4-methylpiperidin-1-yl)phenyl]propyl-benzylazanium Traditional Name: 3-[3-amino-4-(4-methylpiperidino)phenyl]propyl-benzyl-ammonium Formula: C22H32N3+ MolecularWeight: 338.50958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3/c1-18-11-14-25(15-12-18)22-10-9-19(16-21(22)23)8-5-13-24-17-20-6-3-2-4-7-20/h2-4,6-7,9-10,16,18,24H,5,8,11-15,17,23H2,1H3/p+1