tert-butyl 6-(3-piperidin-1-ylpropoxy)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 6-(3-piperidin-1-ylpropoxy)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 6-[3-(1-piperidyl)propoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6-[3-(1-piperidinyl)propoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(3-piperidin-1-ylpropoxy)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-(3-piperidinopropoxy)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C22H34N2O3 MolecularWeight: 374.51696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1)C=CC(=C2)OCCCN3CCCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1)C=CC(=C2)OCCCN3CCCCC3

InChI

InChI=1S/C22H34N2O3/c1-22(2,3)27-21(25)24-14-10-18-16-20(9-8-19(18)17-24)26-15-7-13-23-11-5-4-6-12-23/h8-9,16H,4-7,10-15,17H2,1-3H3