5-[(4-bromanyl-2-methyl-phenyl)amino]-3-(2,4-dichlorophenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(4-bromanyl-2-methyl-phenyl)amino]-3-(2,4-dichlorophenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(4-bromo-2-methyl-anilino)-3-(2,4-dichlorophenyl)-5-oxo-pentanoic acid CAS Name: 5-(4-bromo-2-methylanilino)-3-(2,4-dichlorophenyl)-5-oxopentanoic acid IUPAC Name: 5-(4-bromo-2-methylanilino)-3-(2,4-dichlorophenyl)-5-oxopentanoic acid Traditional Name: 5-(4-bromo-2-methyl-anilino)-3-(2,4-dichlorophenyl)-5-keto-valeric acid Formula: C18H16BrCl2NO3 MolecularWeight: 445.13454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CC(CC(=O)O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CC(CC(=O)O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H16BrCl2NO3/c1-10-6-12(19)2-5-16(10)22-17(23)7-11(8-18(24)25)14-4-3-13(20)9-15(14)21/h2-6,9,11H,7-8H2,1H3,(H,22,23)(H,24,25)