methyl 4-chloranyl-3-[(3,3,5-trimethylcyclohexyl)amino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[(3,3,5-trimethylcyclohexyl)amino]benzoate Openeye Name: methyl 4-chloro-3-[(3,3,5-trimethylcyclohexyl)amino]benzoate CAS Name: 4-chloro-3-[(3,3,5-trimethylcyclohexyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(3,3,5-trimethylcyclohexyl)amino]benzoate Traditional Name: 4-chloro-3-[(3,3,5-trimethylcyclohexyl)amino]benzoic acid methyl ester Formula: C17H24ClNO2 MolecularWeight: 309.83096

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)NC2=C(C=CC(=C2)C(=O)OC)Cl

Isomeric SMILES

CC1CC(CC(C1)(C)C)NC2=C(C=CC(=C2)C(=O)OC)Cl

InChI

InChI=1S/C17H24ClNO2/c1-11-7-13(10-17(2,3)9-11)19-15-8-12(16(20)21-4)5-6-14(15)18/h5-6,8,11,13,19H,7,9-10H2,1-4H3