4-[5-methoxy-4-piperidin-1-yl-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[5-methoxy-4-piperidin-1-yl-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[5-methoxy-4-(1-piperidyl)-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid CAS Name: 4-[5-methoxy-4-(1-piperidinyl)-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[5-methoxy-4-piperidin-1-yl-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[5-methoxy-4-piperidino-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid Formula: C27H43N3O3 MolecularWeight: 457.64862

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)C)C2=CC(=C(C=C2N3CCN(CC3)C(=O)O)OC)N4CCCCC4)C

Isomeric SMILES

CC1(CC(CC(C1)(C)C)C2=CC(=C(C=C2N3CCN(CC3)C(=O)O)OC)N4CCCCC4)C

InChI

InChI=1S/C27H43N3O3/c1-26(2)17-20(18-27(3,4)19-26)21-15-23(28-9-7-6-8-10-28)24(33-5)16-22(21)29-11-13-30(14-12-29)25(31)32/h15-16,20H,6-14,17-19H2,1-5H3,(H,31,32)