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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)OC

Isomeric SMILES

CN(C)CCOC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)OC

InChI

InChI=1S/C18H28N2O4/c1-19(2)9-10-24-16-7-6-14(11-17(16)23-3)12-20-8-4-5-15(13-20)18(21)22/h6-7,11,15H,4-5,8-10,12-13H2,1-3H3,(H,21,22)