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

Systemtic Name: 4-[[5-bromanyl-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[2-[2-(2-allylphenoxy)ethoxy]-5-bromo-phenyl]methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[5-bromo-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[5-bromo-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[2-[2-(2-allylphenoxy)ethoxy]-5-bromo-benzylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C29H28BrN3O3 MolecularWeight: 546.45492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C=CC(=C3)Br)OCCOC4=CC=CC=C4CC=C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C=CC(=C3)Br)OCCOC4=CC=CC=C4CC=C

InChI

InChI=1S/C29H28BrN3O3/c1-4-10-22-11-8-9-14-26(22)35-17-18-36-27-16-15-24(30)19-23(27)20-31-28-21(2)32(3)33(29(28)34)25-12-6-5-7-13-25/h4-9,11-16,19-20H,1,10,17-18H2,2-3H3