[4-[(E)-[(2-bromophenyl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-butoxybenzoate

Systemtic Name: [4-[(E)-[(2-bromophenyl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-butoxybenzoate Openeye Name: [4-[(E)-[(2-bromobenzoyl)hydrazono]methyl]-2-methoxy-phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[(E)-[[(2-bromophenyl)-oxomethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(2-bromobenzoyl)hydrazinylidene]methyl]-2-methoxyphenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[(E)-[(2-bromobenzoyl)hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C26H25BrN2O5 MolecularWeight: 525.3911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=O)C3=CC=CC=C3Br)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=CC=C3Br)OC

InChI

InChI=1S/C26H25BrN2O5/c1-3-4-15-33-20-12-10-19(11-13-20)26(31)34-23-14-9-18(16-24(23)32-2)17-28-29-25(30)21-7-5-6-8-22(21)27/h5-14,16-17H,3-4,15H2,1-2H3,(H,29,30)/b28-17+