2-(4-methylpentanoylamino)-1-(4-methylpentyl)-N-(4-phenylbutyl)pyrrolidine-2-carboxamide

Systemtic Name: 2-(4-methylpentanoylamino)-1-(4-methylpentyl)-N-(4-phenylbutyl)pyrrolidine-2-carboxamide Openeye Name: 1-isohexyl-2-(4-methylpentanoylamino)-N-(4-phenylbutyl)pyrrolidine-2-carboxamide CAS Name: 2-[(4-methyl-1-oxopentyl)amino]-1-(4-methylpentyl)-N-(4-phenylbutyl)-2-pyrrolidinecarboxamide IUPAC Name: 2-(4-methylpentanoylamino)-1-(4-methylpentyl)-N-(4-phenylbutyl)pyrrolidine-2-carboxamide Traditional Name: 1-isohexyl-2-(4-methylpentanoylamino)-N-(4-phenylbutyl)pyrrolidine-2-carboxamide Formula: C27H45N3O2 MolecularWeight: 443.6651

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H45N3O2/c1-22(2)12-10-20-30-21-11-18-27(30,29-25(31)17-16-23(3)4)26(32)28-19-9-8-15-24-13-6-5-7-14-24/h5-7,13-14,22-23H,8-12,15-21H2,1-4H3,(H,28,32)(H,29,31)