tert-butyl 5-[5-(4-methoxyphenyl)pent-4-ynyl]-3,4-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 5-[5-(4-methoxyphenyl)pent-4-ynyl]-3,4-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 5-[5-(4-methoxyphenyl)pent-4-ynyl]-3,4-dihydro-2H-pyridine-1-carboxylate CAS Name: 5-[5-(4-methoxyphenyl)pent-4-ynyl]-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[5-(4-methoxyphenyl)pent-4-ynyl]-3,4-dihydro-2H-pyridine-1-carboxylate Traditional Name: 5-[5-(4-methoxyphenyl)pent-4-ynyl]-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(=C1)CCCC#CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(=C1)CCCC#CC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H29NO3/c1-22(2,3)26-21(24)23-16-8-11-19(17-23)10-7-5-6-9-18-12-14-20(25-4)15-13-18/h12-15,17H,5,7-8,10-11,16H2,1-4H3