[2-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4-bromanyl-phenyl] furan-2-carboxylate

Systemtic Name: [2-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4-bromanyl-phenyl] furan-2-carboxylate Openeye Name: [2-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazono]methyl]-4-bromo-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [2-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]hydrazinylidene]methyl]-4-bromophenyl] ester IUPAC Name: [2-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4-bromophenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [2-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)acryloyl]hydrazono]methyl]-4-bromo-phenyl] ester Formula: C29H20BrN3O7 MolecularWeight: 602.389

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NN=CC3=C(C=CC(=C3)Br)OC(=O)C4=CC=CO4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NN=CC3=C(C=CC(=C3)Br)OC(=O)C4=CC=CO4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H20BrN3O7/c30-21-9-11-23(40-29(36)25-7-4-12-37-25)20(15-21)16-31-33-28(35)22(32-27(34)19-5-2-1-3-6-19)13-18-8-10-24-26(14-18)39-17-38-24/h1-16H,17H2,(H,32,34)(H,33,35)