(phenylmethyl) 2-aminocarbonyl-2-[2-methyl-4,6-bis(oxidanylidene)-6-(3-oxidanylpropylamino)hexan-3-yl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-aminocarbonyl-2-[2-methyl-4,6-bis(oxidanylidene)-6-(3-oxidanylpropylamino)hexan-3-yl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-carbamoyl-2-[4-(3-hydroxypropylamino)-1-isopropyl-2,4-dioxo-butyl]pyrrolidine-1-carboxylate CAS Name: 2-carbamoyl-2-[6-(3-hydroxypropylamino)-2-methyl-4,6-dioxohexan-3-yl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-carbamoyl-2-[6-(3-hydroxypropylamino)-2-methyl-4,6-dioxohexan-3-yl]pyrrolidine-1-carboxylate Traditional Name: 2-carbamoyl-2-[4-(3-hydroxypropylamino)-1-isopropyl-2,4-diketo-butyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C23H33N3O6 MolecularWeight: 447.52462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)CC(=O)NCCCO)C1(CCCN1C(=O)OCC2=CC=CC=C2)C(=O)N

Isomeric SMILES

CC(C)C(C(=O)CC(=O)NCCCO)C1(CCCN1C(=O)OCC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C23H33N3O6/c1-16(2)20(18(28)14-19(29)25-11-7-13-27)23(21(24)30)10-6-12-26(23)22(31)32-15-17-8-4-3-5-9-17/h3-5,8-9,16,20,27H,6-7,10-15H2,1-2H3,(H2,24,30)(H,25,29)