(3-azanyl-4-methoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3-azanyl-4-methoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (3-amino-4-methoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (3-amino-4-methoxyphenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3-amino-4-methoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (3-amino-4-methoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C13H20N3O2+ MolecularWeight: 250.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)N

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)N

InChI

InChI=1S/C13H19N3O2/c1-15-5-7-16(8-6-15)13(17)10-3-4-12(18-2)11(14)9-10/h3-4,9H,5-8,14H2,1-2H3/p+1