methyl 2-[[(4E)-4-[(4-bromophenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-yl]carbonyl-methyl-amino]benzoate

Systemtic Name: methyl 2-[[(4E)-4-[(4-bromophenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-yl]carbonyl-methyl-amino]benzoate Openeye Name: methyl 2-[[(4E)-4-[(4-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carbonyl]-methyl-amino]benzoate CAS Name: 2-[[[(4E)-4-[[(4-bromophenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4E)-4-[(4-bromobenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carbonyl]-methylamino]benzoate Traditional Name: 2-[[(4E)-4-[(4-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carbonyl]-methyl-amino]benzoic acid methyl ester Formula: C26H24BrN3O5 MolecularWeight: 538.38986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)Br)CCC2)C(=O)N(C)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)Br)/CCC2)C(=O)N(C)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C26H24BrN3O5/c1-15-22-19(28-29-24(31)16-11-13-17(27)14-12-16)8-6-10-21(22)35-23(15)25(32)30(2)20-9-5-4-7-18(20)26(33)34-3/h4-5,7,9,11-14H,6,8,10H2,1-3H3,(H,29,31)/b28-19+