1,5-dimethyl-2-phenyl-4-[(3-phenyl-1,4-benzodioxin-2-yl)methylideneamino]pyrazol-3-one

Systemtic Name: 1,5-dimethyl-2-phenyl-4-[(3-phenyl-1,4-benzodioxin-2-yl)methylideneamino]pyrazol-3-one Openeye Name: 1,5-dimethyl-2-phenyl-4-[(3-phenyl-1,4-benzodioxin-2-yl)methyleneamino]pyrazol-3-one CAS Name: 1,5-dimethyl-2-phenyl-4-[(3-phenyl-1,4-benzodioxin-2-yl)methylideneamino]-3-pyrazolone IUPAC Name: 1,5-dimethyl-2-phenyl-4-[(3-phenyl-1,4-benzodioxin-2-yl)methylideneamino]pyrazol-3-one Traditional Name: 1,5-dimethyl-2-phenyl-4-[(3-phenyl-1,4-benzodioxin-2-yl)methyleneamino]-3-pyrazolin-3-one Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(OC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(OC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O3/c1-18-24(26(30)29(28(18)2)20-13-7-4-8-14-20)27-17-23-25(19-11-5-3-6-12-19)32-22-16-10-9-15-21(22)31-23/h3-17H,1-2H3