1-[(R)-(3,4-dichlorophenyl)-pyridin-4-yl-methyl]piperazin-4-ium

Systemtic Name: 1-[(R)-(3,4-dichlorophenyl)-pyridin-4-yl-methyl]piperazin-4-ium Openeye Name: 1-[(R)-(3,4-dichlorophenyl)-(4-pyridyl)methyl]piperazin-4-ium CAS Name: 1-[(R)-(3,4-dichlorophenyl)-pyridin-4-ylmethyl]piperazin-4-ium IUPAC Name: 1-[(R)-(3,4-dichlorophenyl)-pyridin-4-ylmethyl]piperazin-4-ium Traditional Name: 1-[(R)-(3,4-dichlorophenyl)-(4-pyridyl)methyl]piperazin-4-ium Formula: C16H18Cl2N3+ MolecularWeight: 323.24022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(C2=CC=NC=C2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)[C@H](C2=CC=NC=C2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H17Cl2N3/c17-14-2-1-13(11-15(14)18)16(12-3-5-19-6-4-12)21-9-7-20-8-10-21/h1-6,11,16,20H,7-10H2/p+1/t16-/m1/s1