4-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methylamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(6-chloro-7-methyl-2-oxochromen-4-yl)methylamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methylamino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)Cl

InChI

InChI=1S/C22H20ClN3O3/c1-13-9-19-17(11-18(13)23)15(10-20(27)29-19)12-24-21-14(2)25(3)26(22(21)28)16-7-5-4-6-8-16/h4-11,24H,12H2,1-3H3