4-cyano-4-(3-cyclopropyloxy-4-methoxy-phenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 4-cyano-4-(3-cyclopropyloxy-4-methoxy-phenyl)cyclohexane-1-carboxylic acid Openeye Name: 4-cyano-4-[3-(cyclopropoxy)-4-methoxy-phenyl]cyclohexanecarboxylic acid CAS Name: 4-cyano-4-(3-cyclopropyloxy-4-methoxyphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 4-cyano-4-(3-cyclopropyloxy-4-methoxyphenyl)cyclohexane-1-carboxylic acid Traditional Name: 4-cyano-4-[3-(cyclopropoxy)-4-methoxy-phenyl]cyclohexanecarboxylic acid Formula: C18H21NO4 MolecularWeight: 315.36364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(CC2)C(=O)O)C#N)OC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(CC2)C(=O)O)C#N)OC3CC3

InChI

InChI=1S/C18H21NO4/c1-22-15-5-2-13(10-16(15)23-14-3-4-14)18(11-19)8-6-12(7-9-18)17(20)21/h2,5,10,12,14H,3-4,6-9H2,1H3,(H,20,21)