tert-butyl 4-[2-chloranyl-4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-chloranyl-4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(1-benzyl-4-piperidyl)carbamoyl]-2-chloro-phenoxy]piperidine-1-carboxylate CAS Name: 4-[2-chloro-4-[oxo-[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(1-benzylpiperidin-4-yl)carbamoyl]-2-chlorophenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-[(1-benzyl-4-piperidyl)carbamoyl]-2-chloro-phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H38ClN3O4 MolecularWeight: 528.08272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C29H38ClN3O4/c1-29(2,3)37-28(35)33-17-13-24(14-18-33)36-26-10-9-22(19-25(26)30)27(34)31-23-11-15-32(16-12-23)20-21-7-5-4-6-8-21/h4-10,19,23-24H,11-18,20H2,1-3H3,(H,31,34)