4-[[5-bromanyl-2-[2-(3-methylphenoxy)ethoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[5-bromanyl-2-[2-(3-methylphenoxy)ethoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[5-bromo-2-[2-(3-methylphenoxy)ethoxy]phenyl]methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[5-bromo-2-[2-(3-methylphenoxy)ethoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[5-bromo-2-[2-(3-methylphenoxy)ethoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[5-bromo-2-[2-(3-methylphenoxy)ethoxy]benzylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C27H26BrN3O3 MolecularWeight: 520.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC2=C(C=C(C=C2)Br)C=NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC2=C(C=C(C=C2)Br)C=NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C27H26BrN3O3/c1-19-8-7-11-24(16-19)33-14-15-34-25-13-12-22(28)17-21(25)18-29-26-20(2)30(3)31(27(26)32)23-9-5-4-6-10-23/h4-13,16-18H,14-15H2,1-3H3