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

Systemtic Name: 1-[[4-(2-diethylaminoethyloxy)-3-methoxy-phenyl]methyl]piperidine-3-carboxylic acid Openeye Name: 1-[[4-(2-diethylaminoethyloxy)-3-methoxy-phenyl]methyl]piperidine-3-carboxylic acid CAS Name: 1-[[4-(2-diethylaminoethyloxy)-3-methoxyphenyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[[4-(2-diethylaminoethyloxy)-3-methoxyphenyl]methyl]piperidine-3-carboxylic acid Traditional Name: 1-[4-(2-diethylaminoethyloxy)-3-methoxy-benzyl]nipecotic acid Formula: C20H32N2O4 MolecularWeight: 364.47908

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)OC

Isomeric SMILES

CCN(CC)CCOC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)OC

InChI

InChI=1S/C20H32N2O4/c1-4-21(5-2)11-12-26-18-9-8-16(13-19(18)25-3)14-22-10-6-7-17(15-22)20(23)24/h8-9,13,17H,4-7,10-12,14-15H2,1-3H3,(H,23,24)