[1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]-(2-pyrazin-2-ylethyl)azanium

Systemtic Name: [1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]-(2-pyrazin-2-ylethyl)azanium Openeye Name: [1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]-(2-pyrazin-2-ylethyl)ammonium CAS Name: [1-[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]-4-piperidinyl]-[2-(2-pyrazinyl)ethyl]ammonium IUPAC Name: [1-[4-[(2-phenoxyacetyl)amino]phenyl]piperidin-4-yl]-(2-pyrazin-2-ylethyl)azanium Traditional Name: [1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]-(2-pyrazin-2-ylethyl)ammonium Formula: C25H30N5O2+ MolecularWeight: 432.538

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCC2=NC=CN=C2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1[NH2+]CCC2=NC=CN=C2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O2/c31-25(19-32-24-4-2-1-3-5-24)29-21-6-8-23(9-7-21)30-16-11-20(12-17-30)27-13-10-22-18-26-14-15-28-22/h1-9,14-15,18,20,27H,10-13,16-17,19H2,(H,29,31)/p+1