4-tert-butyl-1-[2-(4-methoxyphenyl)propanoylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-tert-butyl-1-[2-(4-methoxyphenyl)propanoylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-tert-butyl-1-[2-(4-methoxyphenyl)propanoylamino]cyclohexanecarboxylic acid CAS Name: 4-tert-butyl-1-[[2-(4-methoxyphenyl)-1-oxopropyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-tert-butyl-1-[2-(4-methoxyphenyl)propanoylamino]cyclohexane-1-carboxylic acid Traditional Name: 4-tert-butyl-1-[2-(4-methoxyphenyl)propanoylamino]cyclohexanecarboxylic acid Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)C(=O)NC2(CCC(CC2)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)OC)C(=O)NC2(CCC(CC2)C(C)(C)C)C(=O)O

InChI

InChI=1S/C21H31NO4/c1-14(15-6-8-17(26-5)9-7-15)18(23)22-21(19(24)25)12-10-16(11-13-21)20(2,3)4/h6-9,14,16H,10-13H2,1-5H3,(H,22,23)(H,24,25)