tert-butyl 2-[3-[2-(3,4-dimethoxyphenyl)-4-methoxy-phenyl]prop-2-ynyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-[3-[2-(3,4-dimethoxyphenyl)-4-methoxy-phenyl]prop-2-ynyl]piperidine-1-carboxylate Openeye Name: tert-butyl 2-[3-[2-(3,4-dimethoxyphenyl)-4-methoxy-phenyl]prop-2-ynyl]piperidine-1-carboxylate CAS Name: 2-[3-[2-(3,4-dimethoxyphenyl)-4-methoxyphenyl]prop-2-ynyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[2-(3,4-dimethoxyphenyl)-4-methoxyphenyl]prop-2-ynyl]piperidine-1-carboxylate Traditional Name: 2-[3-[2-(3,4-dimethoxyphenyl)-4-methoxy-phenyl]prop-2-ynyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H35NO5 MolecularWeight: 465.5812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1CC#CC2=C(C=C(C=C2)OC)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCC1CC#CC2=C(C=C(C=C2)OC)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C28H35NO5/c1-28(2,3)34-27(30)29-17-8-7-11-22(29)12-9-10-20-13-15-23(31-4)19-24(20)21-14-16-25(32-5)26(18-21)33-6/h13-16,18-19,22H,7-8,11-12,17H2,1-6H3