(3-methoxy-2-oxidanyl-phenyl)-piperazin-4-ium-1-yl-methanone

Systemtic Name: (3-methoxy-2-oxidanyl-phenyl)-piperazin-4-ium-1-yl-methanone Openeye Name: (2-hydroxy-3-methoxy-phenyl)-piperazin-4-ium-1-yl-methanone CAS Name: (2-hydroxy-3-methoxyphenyl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (2-hydroxy-3-methoxyphenyl)-piperazin-4-ium-1-ylmethanone Traditional Name: (2-hydroxy-3-methoxy-phenyl)-piperazin-4-ium-1-yl-methanone Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

COC1=CC=CC(=C1O)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C12H16N2O3/c1-17-10-4-2-3-9(11(10)15)12(16)14-7-5-13-6-8-14/h2-4,13,15H,5-8H2,1H3/p+1