[4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylhydrazinylidene)methyl]phenyl] 4-tert-butylbenzoate

Systemtic Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylhydrazinylidene)methyl]phenyl] 4-tert-butylbenzoate Openeye Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxine-6-carbonylhydrazono)methyl]phenyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [4-[(E)-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxine-6-carbonylhydrazinylidene)methyl]phenyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-carbonylhydrazono)methyl]phenyl] ester Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C27H26N2O5/c1-27(2,3)21-9-6-19(7-10-21)26(31)34-22-11-4-18(5-12-22)17-28-29-25(30)20-8-13-23-24(16-20)33-15-14-32-23/h4-13,16-17H,14-15H2,1-3H3,(H,29,30)/b28-17+