2-methyl-4-oxidanylidene-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]cyclohex-2-ene-1-carboxylic acid

Systemtic Name: 2-methyl-4-oxidanylidene-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]cyclohex-2-ene-1-carboxylic acid Openeye Name: 2-methyl-4-oxo-3-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]cyclohex-2-ene-1-carboxylic acid CAS Name: 2-methyl-4-oxo-3-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-cyclohex-2-enecarboxylic acid IUPAC Name: 2-methyl-4-oxo-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]cyclohex-2-ene-1-carboxylic acid Traditional Name: 4-keto-2-methyl-3-[4-(2-piperidinoethoxy)benzyl]cyclohex-2-ene-1-carboxylic acid Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CCC1C(=O)O)CC2=CC=C(C=C2)OCCN3CCCCC3

Isomeric SMILES

CC1=C(C(=O)CCC1C(=O)O)CC2=CC=C(C=C2)OCCN3CCCCC3

InChI

InChI=1S/C22H29NO4/c1-16-19(22(25)26)9-10-21(24)20(16)15-17-5-7-18(8-6-17)27-14-13-23-11-3-2-4-12-23/h5-8,19H,2-4,9-15H2,1H3,(H,25,26)