3-azanyl-5-(2-oxidanyl-5-phenoxy-phenyl)-1-piperidin-3-yl-pyrazin-2-one

Systemtic Name: 3-azanyl-5-(2-oxidanyl-5-phenoxy-phenyl)-1-piperidin-3-yl-pyrazin-2-one Openeye Name: 3-amino-5-(2-hydroxy-5-phenoxy-phenyl)-1-(3-piperidyl)pyrazin-2-one CAS Name: 3-amino-5-(2-hydroxy-5-phenoxyphenyl)-1-(3-piperidinyl)-2-pyrazinone IUPAC Name: 3-amino-5-(2-hydroxy-5-phenoxyphenyl)-1-piperidin-3-ylpyrazin-2-one Traditional Name: 3-amino-5-(2-hydroxy-5-phenoxy-phenyl)-1-(3-piperidyl)pyrazin-2-one Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=C(C=CC(=C3)OC4=CC=CC=C4)O

Isomeric SMILES

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=C(C=CC(=C3)OC4=CC=CC=C4)O

InChI

InChI=1S/C21H22N4O3/c22-20-21(27)25(14-5-4-10-23-12-14)13-18(24-20)17-11-16(8-9-19(17)26)28-15-6-2-1-3-7-15/h1-3,6-9,11,13-14,23,26H,4-5,10,12H2,(H2,22,24)