[4-[(E)-[2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate

Systemtic Name: [4-[(E)-[2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[(E)-[[2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetyl]hydrazono]methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[(E)-[[2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[(E)-[[2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C30H33BrN2O5 MolecularWeight: 581.49742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)COC3=C(C=C(C(=C3)C)Br)C(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)COC3=C(C=C(C(=C3)C)Br)C(C)C

InChI

InChI=1S/C30H33BrN2O5/c1-5-6-15-36-24-13-9-23(10-14-24)30(35)38-25-11-7-22(8-12-25)18-32-33-29(34)19-37-28-16-21(4)27(31)17-26(28)20(2)3/h7-14,16-18,20H,5-6,15,19H2,1-4H3,(H,33,34)/b32-18+