(3-methoxyphenyl)-(4-piperazin-4-ium-1-ylphenyl)methanone

Systemtic Name: (3-methoxyphenyl)-(4-piperazin-4-ium-1-ylphenyl)methanone Openeye Name: (3-methoxyphenyl)-(4-piperazin-4-ium-1-ylphenyl)methanone CAS Name: (3-methoxyphenyl)-[4-(1-piperazin-4-iumyl)phenyl]methanone IUPAC Name: (3-methoxyphenyl)-(4-piperazin-4-ium-1-ylphenyl)methanone Traditional Name: (3-methoxyphenyl)-(4-piperazin-4-ium-1-ylphenyl)methanone Formula: C18H21N2O2+ MolecularWeight: 297.37154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C2=CC=C(C=C2)N3CC[NH2+]CC3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C2=CC=C(C=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C18H20N2O2/c1-22-17-4-2-3-15(13-17)18(21)14-5-7-16(8-6-14)20-11-9-19-10-12-20/h2-8,13,19H,9-12H2,1H3/p+1