methyl (4Z)-4-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-4-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(5-bromo-2-hydroxy-phenyl)methylene]-1-(3-methoxypropyl)-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-4-(5-bromo-2-hydroxy-benzylidene)-5-keto-1-(3-methoxypropyl)-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C18H20BrNO5 MolecularWeight: 410.2591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C(C=CC(=C2)Br)O)C(=O)N1CCCOC)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=C(C=CC(=C2)Br)O)/C(=O)N1CCCOC)C(=O)OC

InChI

InChI=1S/C18H20BrNO5/c1-11-16(18(23)25-3)14(17(22)20(11)7-4-8-24-2)10-12-9-13(19)5-6-15(12)21/h5-6,9-10,21H,4,7-8H2,1-3H3/b14-10-