1-[[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[4-(2-dimethylaminoethyloxy)-3-methoxy-benzyl]isonipecotic acid Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=C(C=C1)CN2CCC(CC2)C(=O)O)OC

Isomeric SMILES

CN(C)CCOC1=C(C=C(C=C1)CN2CCC(CC2)C(=O)O)OC

InChI

InChI=1S/C18H28N2O4/c1-19(2)10-11-24-16-5-4-14(12-17(16)23-3)13-20-8-6-15(7-9-20)18(21)22/h4-5,12,15H,6-11,13H2,1-3H3,(H,21,22)