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

Systemtic Name: 3-[3-azanyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-(4-methylpiperazin-1-yl)propan-1-one Openeye Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-(4-methylpiperazin-1-yl)propan-1-one CAS Name: 3-[3-amino-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-1-(4-methyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-(4-methylpiperazin-1-yl)propan-1-one Traditional Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-(4-methylpiperazino)propan-1-one Formula: C19H32N5O+ MolecularWeight: 346.49028

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)CCC(=O)N3CCN(CC3)C)N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)CCC(=O)N3CCN(CC3)C)N

InChI

InChI=1S/C19H31N5O/c1-21-7-11-23(12-8-21)18-5-3-16(15-17(18)20)4-6-19(25)24-13-9-22(2)10-14-24/h3,5,15H,4,6-14,20H2,1-2H3/p+1