methyl 4-[(2,6-dimethylcyclohexyl)amino]-3-methyl-benzoate

Systemtic Name: methyl 4-[(2,6-dimethylcyclohexyl)amino]-3-methyl-benzoate Openeye Name: methyl 4-[(2,6-dimethylcyclohexyl)amino]-3-methyl-benzoate CAS Name: 4-[(2,6-dimethylcyclohexyl)amino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[(2,6-dimethylcyclohexyl)amino]-3-methylbenzoate Traditional Name: 4-[(2,6-dimethylcyclohexyl)amino]-3-methyl-benzoic acid methyl ester Formula: C17H25NO2 MolecularWeight: 275.3859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1NC2=C(C=C(C=C2)C(=O)OC)C)C

Isomeric SMILES

CC1CCCC(C1NC2=C(C=C(C=C2)C(=O)OC)C)C

InChI

InChI=1S/C17H25NO2/c1-11-6-5-7-12(2)16(11)18-15-9-8-14(10-13(15)3)17(19)20-4/h8-12,16,18H,5-7H2,1-4H3