4-[(3-methoxy-4-prop-2-ynoxy-phenyl)-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]-3-methyl-2H-1,2-oxazol-5-one

Systemtic Name: 4-[(3-methoxy-4-prop-2-ynoxy-phenyl)-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]-3-methyl-2H-1,2-oxazol-5-one Openeye Name: 4-[(3-methoxy-4-prop-2-ynoxy-phenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-3-methyl-2H-isoxazol-5-one CAS Name: 4-[(3-methoxy-4-prop-2-ynoxyphenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-3-methyl-2H-isoxazol-5-one IUPAC Name: 4-[(3-methoxy-4-prop-2-ynoxyphenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-3-methyl-2H-1,2-oxazol-5-one Traditional Name: 4-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)-(3-methoxy-4-propargyloxy-phenyl)methyl]-3-methyl-3-isoxazolin-5-one Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC(=C(C=C3)OCC#C)OC)C4=C(NOC4=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC(=C(C=C3)OCC#C)OC)C4=C(NOC4=O)C

InChI

InChI=1S/C25H23N3O5/c1-5-13-32-19-12-11-17(14-20(19)31-4)23(22-16(3)27-33-25(22)30)21-15(2)26-28(24(21)29)18-9-7-6-8-10-18/h1,6-12,14,23,26-27H,13H2,2-4H3