4-[4-(4-methoxypiperidin-1-yl)-2-spiro[5.5]undecan-9-yl-phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[4-(4-methoxypiperidin-1-yl)-2-spiro[5.5]undecan-9-yl-phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[4-(4-methoxy-1-piperidyl)-2-spiro[5.5]undecan-9-yl-phenyl]piperazine-1-carboxylic acid CAS Name: 4-[4-(4-methoxy-1-piperidinyl)-2-(9-spiro[5.5]undecanyl)phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[4-(4-methoxypiperidin-1-yl)-2-spiro[5.5]undecan-9-ylphenyl]piperazine-1-carboxylic acid Traditional Name: 4-[4-(4-methoxypiperidino)-2-spiro[5.5]undecan-9-yl-phenyl]piperazine-1-carboxylic acid Formula: C28H43N3O3 MolecularWeight: 469.65932

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)O)C4CCC5(CCCCC5)CC4

Isomeric SMILES

COC1CCN(CC1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)O)C4CCC5(CCCCC5)CC4

InChI

InChI=1S/C28H43N3O3/c1-34-24-9-15-29(16-10-24)23-5-6-26(30-17-19-31(20-18-30)27(32)33)25(21-23)22-7-13-28(14-8-22)11-3-2-4-12-28/h5-6,21-22,24H,2-4,7-20H2,1H3,(H,32,33)