1-[2-(4-chloranyl-2-methyl-phenyl)ethanoylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-(4-chloranyl-2-methyl-phenyl)ethanoylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[[2-(4-chloro-2-methyl-phenyl)acetyl]amino]cycloheptanecarboxylic acid CAS Name: 1-[[2-(4-chloro-2-methylphenyl)-1-oxoethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[[2-(4-chloro-2-methylphenyl)acetyl]amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[[2-(4-chloro-2-methyl-phenyl)acetyl]amino]cycloheptanecarboxylic acid Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)CC(=O)NC2(CCCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)CC(=O)NC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C17H22ClNO3/c1-12-10-14(18)7-6-13(12)11-15(20)19-17(16(21)22)8-4-2-3-5-9-17/h6-7,10H,2-5,8-9,11H2,1H3,(H,19,20)(H,21,22)