[1-[3-[(2-methoxyphenyl)carbonylamino]phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: [1-[3-[(2-methoxyphenyl)carbonylamino]phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Openeye Name: [1-[3-[(2-methoxybenzoyl)amino]phenyl]-4-piperidyl]-(3-pyridylmethyl)ammonium CAS Name: [1-[3-[[(2-methoxyphenyl)-oxomethyl]amino]phenyl]-4-piperidinyl]-(3-pyridinylmethyl)ammonium IUPAC Name: [1-[3-[(2-methoxybenzoyl)amino]phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Traditional Name: [1-[3-(o-anisoylamino)phenyl]-4-piperidyl]-(3-pyridylmethyl)ammonium Formula: C25H29N4O2+ MolecularWeight: 417.52336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CC4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CC4=CN=CC=C4

InChI

InChI=1S/C25H28N4O2/c1-31-24-10-3-2-9-23(24)25(30)28-21-7-4-8-22(16-21)29-14-11-20(12-15-29)27-18-19-6-5-13-26-17-19/h2-10,13,16-17,20,27H,11-12,14-15,18H2,1H3,(H,28,30)/p+1