3-[3-azanyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-piperidin-1-yl-propan-1-one

Systemtic Name: 3-[3-azanyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-(1-piperidyl)propan-1-one CAS Name: 3-[3-amino-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-piperidino-propan-1-one Formula: C19H31N4O+ MolecularWeight: 331.47564

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)CCC(=O)N3CCCCC3)N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)CCC(=O)N3CCCCC3)N

InChI

InChI=1S/C19H30N4O/c1-21-11-13-22(14-12-21)18-7-5-16(15-17(18)20)6-8-19(24)23-9-3-2-4-10-23/h5,7,15H,2-4,6,8-14,20H2,1H3/p+1