2-[4-[3-(cycloheptylidenemethyl)-4-methoxy-phenyl]piperidin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[3-(cycloheptylidenemethyl)-4-methoxy-phenyl]piperidin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[3-(cycloheptylidenemethyl)-4-methoxy-phenyl]-1-piperidyl]-2-oxo-acetic acid CAS Name: 2-[4-[3-(cycloheptylidenemethyl)-4-methoxyphenyl]-1-piperidinyl]-2-oxoacetic acid IUPAC Name: 2-[4-[3-(cycloheptylidenemethyl)-4-methoxyphenyl]piperidin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-[3-(cycloheptylidenemethyl)-4-methoxy-phenyl]piperidino]-2-keto-acetic acid Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCN(CC2)C(=O)C(=O)O)C=C3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCN(CC2)C(=O)C(=O)O)C=C3CCCCCC3

InChI

InChI=1S/C22H29NO4/c1-27-20-9-8-18(15-19(20)14-16-6-4-2-3-5-7-16)17-10-12-23(13-11-17)21(24)22(25)26/h8-9,14-15,17H,2-7,10-13H2,1H3,(H,25,26)