tert-butyl 6-[3-(1-propan-2-yloxycarbonylpiperidin-4-yl)propylamino]-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 6-[3-(1-propan-2-yloxycarbonylpiperidin-4-yl)propylamino]-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 6-[3-(1-isopropoxycarbonyl-4-piperidyl)propylamino]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6-[3-[1-[oxo(propan-2-yloxy)methyl]-4-piperidinyl]propylamino]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-[3-(1-propan-2-yloxycarbonylpiperidin-4-yl)propylamino]-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-[3-(1-isopropoxycarbonyl-4-piperidyl)propylamino]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C26H41N3O4 MolecularWeight: 459.62144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)CCCNC2=CC3=C(CN(CC3)C(=O)OC(C)(C)C)C=C2

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)CCCNC2=CC3=C(CN(CC3)C(=O)OC(C)(C)C)C=C2

InChI

InChI=1S/C26H41N3O4/c1-19(2)32-24(30)28-14-10-20(11-15-28)7-6-13-27-23-9-8-22-18-29(16-12-21(22)17-23)25(31)33-26(3,4)5/h8-9,17,19-20,27H,6-7,10-16,18H2,1-5H3