1-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-(2,3,4-trimethoxybenzyl)piperazin-4-ium Formula: C20H26ClN2O3+ MolecularWeight: 377.88504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)OC)OC

InChI

InChI=1S/C20H25ClN2O3/c1-24-18-8-7-15(19(25-2)20(18)26-3)14-22-9-11-23(12-10-22)17-6-4-5-16(21)13-17/h4-8,13H,9-12,14H2,1-3H3/p+1