tert-butyl N-[1-(4-methylpentyl)-2-(4-phenylbutylcarbamoyl)piperidin-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(4-methylpentyl)-2-(4-phenylbutylcarbamoyl)piperidin-2-yl]carbamate Openeye Name: tert-butyl N-[1-isohexyl-2-(4-phenylbutylcarbamoyl)-2-piperidyl]carbamate CAS Name: N-[1-(4-methylpentyl)-2-[oxo-(4-phenylbutylamino)methyl]-2-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(4-methylpentyl)-2-(4-phenylbutylcarbamoyl)piperidin-2-yl]carbamate Traditional Name: N-[1-isohexyl-2-(4-phenylbutylcarbamoyl)-2-piperidyl]carbamic acid tert-butyl ester Formula: C27H45N3O3 MolecularWeight: 459.6645

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1CCCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCCN1CCCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H45N3O3/c1-22(2)14-13-21-30-20-12-10-18-27(30,29-25(32)33-26(3,4)5)24(31)28-19-11-9-17-23-15-7-6-8-16-23/h6-8,15-16,22H,9-14,17-21H2,1-5H3,(H,28,31)(H,29,32)