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

Systemtic Name: tert-butyl N-[1-(4-methylpentyl)-2-(4-phenylbutylcarbamoyl)pyrrolidin-2-yl]carbamate Openeye Name: tert-butyl N-[1-isohexyl-2-(4-phenylbutylcarbamoyl)pyrrolidin-2-yl]carbamate CAS Name: N-[1-(4-methylpentyl)-2-[oxo-(4-phenylbutylamino)methyl]-2-pyrrolidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(4-methylpentyl)-2-(4-phenylbutylcarbamoyl)pyrrolidin-2-yl]carbamate Traditional Name: N-[1-isohexyl-2-(4-phenylbutylcarbamoyl)pyrrolidin-2-yl]carbamic acid tert-butyl ester Formula: C26H43N3O3 MolecularWeight: 445.63792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1CCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCCN1CCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H43N3O3/c1-21(2)13-11-19-29-20-12-17-26(29,28-24(31)32-25(3,4)5)23(30)27-18-10-9-16-22-14-7-6-8-15-22/h6-8,14-15,21H,9-13,16-20H2,1-5H3,(H,27,30)(H,28,31)