5-(4-chlorophenyl)-3-[4-(2-methoxyethyl)piperazin-4-ium-1-yl]-1,2,4-triazine

Systemtic Name: 5-(4-chlorophenyl)-3-[4-(2-methoxyethyl)piperazin-4-ium-1-yl]-1,2,4-triazine Openeye Name: 5-(4-chlorophenyl)-3-[4-(2-methoxyethyl)piperazin-4-ium-1-yl]-1,2,4-triazine CAS Name: 5-(4-chlorophenyl)-3-[4-(2-methoxyethyl)-1-piperazin-4-iumyl]-1,2,4-triazine IUPAC Name: 5-(4-chlorophenyl)-3-[4-(2-methoxyethyl)piperazin-4-ium-1-yl]-1,2,4-triazine Traditional Name: 5-(4-chlorophenyl)-3-[4-(2-methoxyethyl)piperazin-4-ium-1-yl]-1,2,4-triazine Formula: C16H21ClN5O+ MolecularWeight: 334.82384

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCN(CC1)C2=NC(=CN=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

COCC[NH+]1CCN(CC1)C2=NC(=CN=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H20ClN5O/c1-23-11-10-21-6-8-22(9-7-21)16-19-15(12-18-20-16)13-2-4-14(17)5-3-13/h2-5,12H,6-11H2,1H3/p+1