4-[bis(3-methylphenoxy)phosphorylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[bis(3-methylphenoxy)phosphorylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[bis(3-methylphenoxy)phosphorylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[bis(3-methylphenoxy)phosphorylamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[bis(3-methylphenoxy)phosphorylamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[bis(3-methylphenoxy)phosphorylamino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C25H26N3O4P MolecularWeight: 463.465401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OP(=O)(NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)OC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)OP(=O)(NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)OC4=CC=CC(=C4)C

InChI

InChI=1S/C25H26N3O4P/c1-18-10-8-14-22(16-18)31-33(30,32-23-15-9-11-19(2)17-23)26-24-20(3)27(4)28(25(24)29)21-12-6-5-7-13-21/h5-17H,1-4H3,(H,26,30)