N-[(2R)-2-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(2R)-2-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[(2R)-2-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[(2R)-2-[4-[(4-phenyl-1-piperazin-1-iumyl)methyl]phenoxy]propyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[(2R)-2-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[(2R)-2-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]-2-piperidin-1-ium-1-yl-acetamide Formula: C27H40N4O2+2 MolecularWeight: 452.6321

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C[NH+]1CCCCC1)OC2=CC=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CNC(=O)C[NH+]1CCCCC1)OC2=CC=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H38N4O2/c1-23(20-28-27(32)22-29-14-6-3-7-15-29)33-26-12-10-24(11-13-26)21-30-16-18-31(19-17-30)25-8-4-2-5-9-25/h2,4-5,8-13,23H,3,6-7,14-22H2,1H3,(H,28,32)/p+2/t23-/m1/s1