[(Z)-(4-butoxyphenyl)methylideneamino] 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate

Systemtic Name: [(Z)-(4-butoxyphenyl)methylideneamino] 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate Openeye Name: [(Z)-(4-butoxyphenyl)methyleneamino] 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate CAS Name: 3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]benzoic acid [(Z)-(4-butoxyphenyl)methylideneamino] ester IUPAC Name: [(Z)-(4-butoxyphenyl)methylideneamino] 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzoate Traditional Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]benzoic acid [(Z)-(4-butoxybenzylidene)amino] ester Formula: C24H26BrN3O3 MolecularWeight: 484.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NOC(=O)C2=CC(=CC=C2)CN3C(=C(C(=N3)C)Br)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N\OC(=O)C2=CC(=CC=C2)CN3C(=C(C(=N3)C)Br)C

InChI

InChI=1S/C24H26BrN3O3/c1-4-5-13-30-22-11-9-19(10-12-22)15-26-31-24(29)21-8-6-7-20(14-21)16-28-18(3)23(25)17(2)27-28/h6-12,14-15H,4-5,13,16H2,1-3H3/b26-15-