[4-[(4-bromanyl-2-nitro-phenyl)amino]-2-chloranyl-phenyl]-(4-butyl-2-methyl-phenyl)methanone

Systemtic Name: [4-[(4-bromanyl-2-nitro-phenyl)amino]-2-chloranyl-phenyl]-(4-butyl-2-methyl-phenyl)methanone Openeye Name: [4-(4-bromo-2-nitro-anilino)-2-chloro-phenyl]-(4-butyl-2-methyl-phenyl)methanone CAS Name: [4-(4-bromo-2-nitroanilino)-2-chlorophenyl]-(4-butyl-2-methylphenyl)methanone IUPAC Name: [4-(4-bromo-2-nitroanilino)-2-chlorophenyl]-(4-butyl-2-methylphenyl)methanone Traditional Name: [4-(4-bromo-2-nitro-anilino)-2-chloro-phenyl]-(4-butyl-2-methyl-phenyl)methanone Formula: C24H22BrClN2O3 MolecularWeight: 501.80008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)NC3=C(C=C(C=C3)Br)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)NC3=C(C=C(C=C3)Br)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C24H22BrClN2O3/c1-3-4-5-16-6-9-19(15(2)12-16)24(29)20-10-8-18(14-21(20)26)27-22-11-7-17(25)13-23(22)28(30)31/h6-14,27H,3-5H2,1-2H3