2-imidazol-1-ylethyl-[1-[4-[2-(4-methoxyphenyl)ethanoylamino]phenyl]piperidin-4-yl]azanium

Systemtic Name: 2-imidazol-1-ylethyl-[1-[4-[2-(4-methoxyphenyl)ethanoylamino]phenyl]piperidin-4-yl]azanium Openeye Name: 2-imidazol-1-ylethyl-[1-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]-4-piperidyl]ammonium CAS Name: 2-(1-imidazolyl)ethyl-[1-[4-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-imidazol-1-ylethyl-[1-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]piperidin-4-yl]azanium Traditional Name: 2-imidazol-1-ylethyl-[1-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]-4-piperidyl]ammonium Formula: C25H32N5O2+ MolecularWeight: 434.55388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)N3CCC(CC3)[NH2+]CCN4C=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)N3CCC(CC3)[NH2+]CCN4C=CN=C4

InChI

InChI=1S/C25H31N5O2/c1-32-24-8-2-20(3-9-24)18-25(31)28-22-4-6-23(7-5-22)30-14-10-21(11-15-30)27-13-17-29-16-12-26-19-29/h2-9,12,16,19,21,27H,10-11,13-15,17-18H2,1H3,(H,28,31)/p+1