N-[4-[(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]ethanamide

Systemtic Name: N-[4-[(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]ethanamide Openeye Name: N-[4-[(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]acetamide CAS Name: N-[4-[[4-(2-quinolin-1-iumyl)-1-piperazin-1-iumyl]methyl]phenyl]acetamide IUPAC Name: N-[4-[(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]acetamide Traditional Name: N-[4-[(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]acetamide Formula: C22H26N4O+2 MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=[NH+]C4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=[NH+]C4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24N4O/c1-17(27)23-20-9-6-18(7-10-20)16-25-12-14-26(15-13-25)22-11-8-19-4-2-3-5-21(19)24-22/h2-11H,12-16H2,1H3,(H,23,27)/p+2