1-[2-[(5-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(5-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(5-bromo-2-methyl-anilino)-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-(5-bromo-2-methylanilino)-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(5-bromo-2-methylanilino)-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-(5-bromo-2-methyl-anilino)-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)NC(=O)CC2(CCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Br)NC(=O)CC2(CCCCC2)C(=O)O

InChI

InChI=1S/C16H20BrNO3/c1-11-5-6-12(17)9-13(11)18-14(19)10-16(15(20)21)7-3-2-4-8-16/h5-6,9H,2-4,7-8,10H2,1H3,(H,18,19)(H,20,21)