(7-tert-butyl-1-benzofuran-2-yl) N-[1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylcarbamoyl-phenethyl-carbamoyl]cyclopentyl]carbamate

Systemtic Name: (7-tert-butyl-1-benzofuran-2-yl) N-[1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylcarbamoyl-phenethyl-carbamoyl]cyclopentyl]carbamate Openeye Name: (7-tert-butylbenzofuran-2-yl) N-[1-[phenethyl-[[1-(tetrahydropyran-4-ylmethyl)-4-piperidyl]methylcarbamoyl]carbamoyl]cyclopentyl]carbamate CAS Name: N-[1-[[[[[1-(4-oxanylmethyl)-4-piperidinyl]methylamino]-oxomethyl]-phenethylamino]-oxomethyl]cyclopentyl]carbamic acid (7-tert-butyl-2-benzofuranyl) ester IUPAC Name: (7-tert-butyl-1-benzofuran-2-yl) N-[1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylcarbamoyl-phenethylcarbamoyl]cyclopentyl]carbamate Traditional Name: N-[1-[phenethyl-[[1-(tetrahydropyran-4-ylmethyl)-4-piperidyl]methylcarbamoyl]carbamoyl]cyclopentyl]carbamic acid (7-tert-butylbenzofuran-2-yl) ester Formula: C40H54N4O6 MolecularWeight: 686.87996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC2=C1OC(=C2)OC(=O)NC3(CCCC3)C(=O)N(CCC4=CC=CC=C4)C(=O)NCC5CCN(CC5)CC6CCOCC6

Isomeric SMILES

CC(C)(C)C1=CC=CC2=C1OC(=C2)OC(=O)NC3(CCCC3)C(=O)N(CCC4=CC=CC=C4)C(=O)NCC5CCN(CC5)CC6CCOCC6

InChI

InChI=1S/C40H54N4O6/c1-39(2,3)33-13-9-12-32-26-34(49-35(32)33)50-38(47)42-40(19-7-8-20-40)36(45)44(23-16-29-10-5-4-6-11-29)37(46)41-27-30-14-21-43(22-15-30)28-31-17-24-48-25-18-31/h4-6,9-13,26,30-31H,7-8,14-25,27-28H2,1-3H3,(H,41,46)(H,42,47)