2H-chromen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: 2H-chromen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: 2H-chromen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: 2H-1-benzopyran-3-yl-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: 2H-chromen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: 2H-chromen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C15H19N2O2+ MolecularWeight: 259.32356

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC3=CC=CC=C3OC2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC3=CC=CC=C3OC2

InChI

InChI=1S/C15H18N2O2/c1-16-6-8-17(9-7-16)15(18)13-10-12-4-2-3-5-14(12)19-11-13/h2-5,10H,6-9,11H2,1H3/p+1