1-ethyl-4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-ethyl-4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-4-carbonitrile Openeye Name: 1-ethyl-4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-4-carbonitrile CAS Name: 1-ethyl-4-(4-phenyl-1-piperazin-1-iumyl)-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-ethyl-4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-4-carbonitrile Traditional Name: 1-ethyl-4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-4-carbonitrile Formula: C18H28N4+2 MolecularWeight: 300.44172

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)(C#N)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCC(CC1)(C#N)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H26N4/c1-2-20-10-8-18(16-19,9-11-20)22-14-12-21(13-15-22)17-6-4-3-5-7-17/h3-7H,2,8-15H2,1H3/p+2