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

Systemtic Name: 3-[3-azanyl-4-(4-methylpiperidin-1-yl)phenyl]propyl-(3-methylbutyl)azanium Openeye Name: 3-[3-amino-4-(4-methyl-1-piperidyl)phenyl]propyl-isopentyl-ammonium CAS Name: 3-[3-amino-4-(4-methyl-1-piperidinyl)phenyl]propyl-(3-methylbutyl)ammonium IUPAC Name: 3-[3-amino-4-(4-methylpiperidin-1-yl)phenyl]propyl-(3-methylbutyl)azanium Traditional Name: 3-[3-amino-4-(4-methylpiperidino)phenyl]propyl-isoamyl-ammonium Formula: C20H36N3+ MolecularWeight: 318.51994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H35N3/c1-16(2)8-12-22-11-4-5-18-6-7-20(19(21)15-18)23-13-9-17(3)10-14-23/h6-7,15-17,22H,4-5,8-14,21H2,1-3H3/p+1