2-[3-chloranyl-5-methyl-4-(4-oxidanyl-3-piperidin-1-ylcarbonyl-phenoxy)phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[3-chloranyl-5-methyl-4-(4-oxidanyl-3-piperidin-1-ylcarbonyl-phenoxy)phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[3-chloro-4-[4-hydroxy-3-(piperidine-1-carbonyl)phenoxy]-5-methyl-phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[3-chloro-4-[4-hydroxy-3-[oxo(1-piperidinyl)methyl]phenoxy]-5-methylphenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[3-chloro-4-[4-hydroxy-3-(piperidine-1-carbonyl)phenoxy]-5-methylphenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[3-chloro-4-[4-hydroxy-3-(piperidine-1-carbonyl)phenoxy]-5-methyl-phenyl]-1,2,4-triazine-3,5-quinone Formula: C22H21ClN4O5 MolecularWeight: 456.87894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)N3CCCCC3)Cl)N4C(=O)NC(=O)C=N4

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)N3CCCCC3)Cl)N4C(=O)NC(=O)C=N4

InChI

InChI=1S/C22H21ClN4O5/c1-13-9-14(27-22(31)25-19(29)12-24-27)10-17(23)20(13)32-15-5-6-18(28)16(11-15)21(30)26-7-3-2-4-8-26/h5-6,9-12,28H,2-4,7-8H2,1H3,(H,25,29,31)