N-[2,6-bis(bromanyl)-4-nitro-phenyl]-5-[(4-chloranyl-3-methyl-phenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-5-[(4-chloranyl-3-methyl-phenoxy)methyl]furan-2-carboxamide Openeye Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-N-(2,6-dibromo-4-nitro-phenyl)furan-2-carboxamide CAS Name: 5-[(4-chloro-3-methylphenoxy)methyl]-N-(2,6-dibromo-4-nitrophenyl)-2-furancarboxamide IUPAC Name: 5-[(4-chloro-3-methylphenoxy)methyl]-N-(2,6-dibromo-4-nitrophenyl)furan-2-carboxamide Traditional Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-N-(2,6-dibromo-4-nitro-phenyl)-2-furamide Formula: C19H13Br2ClN2O5 MolecularWeight: 544.57792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)Cl

InChI

InChI=1S/C19H13Br2ClN2O5/c1-10-6-12(2-4-16(10)22)28-9-13-3-5-17(29-13)19(25)23-18-14(20)7-11(24(26)27)8-15(18)21/h2-8H,9H2,1H3,(H,23,25)