4-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(3-keto-4,5-dimethoxy-phthalan-1-yl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3C4=C(C(=C(C=C4)OC)OC)C(=O)O3

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3C4=C(C(=C(C=C4)OC)OC)C(=O)O3

InChI

InChI=1S/C21H21N3O5/c1-12-17(20(25)24(23(12)2)13-8-6-5-7-9-13)22-19-14-10-11-15(27-3)18(28-4)16(14)21(26)29-19/h5-11,19,22H,1-4H3