(3-chlorophenyl)-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-chlorophenyl)-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-chlorophenyl)-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-chlorophenyl)-[4-[(2,3-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-chlorophenyl)-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-chlorophenyl)-(4-o-veratrylpiperazin-4-ium-1-yl)methanone Formula: C20H24ClN2O3+ MolecularWeight: 375.86916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1OC)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O3/c1-25-18-8-4-6-16(19(18)26-2)14-22-9-11-23(12-10-22)20(24)15-5-3-7-17(21)13-15/h3-8,13H,9-12,14H2,1-2H3/p+1