5-[[(4-tert-butylcyclohexyl)carbonylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[(4-tert-butylcyclohexyl)carbonylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[(4-tert-butylcyclohexanecarbonyl)amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[(4-tert-butylcyclohexyl)-oxomethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[(4-tert-butylcyclohexanecarbonyl)amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[(4-tert-butylcyclohexanecarbonyl)amino]methyl]-2-methoxy-benzoic acid Formula: C20H29NO4 MolecularWeight: 347.44856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C20H29NO4/c1-20(2,3)15-8-6-14(7-9-15)18(22)21-12-13-5-10-17(25-4)16(11-13)19(23)24/h5,10-11,14-15H,6-9,12H2,1-4H3,(H,21,22)(H,23,24)