(phenylmethyl) 2-[[[1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)pyrrolidin-2-yl]carbonylamino]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[[[1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)pyrrolidin-2-yl]carbonylamino]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[[[1-(3,3-dimethyl-2-oxo-pentanoyl)pyrrolidine-2-carbonyl]amino]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[[1-(3,3-dimethyl-1,2-dioxopentyl)-2-pyrrolidinyl]-oxomethyl]hydrazo]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[[1-(3,3-dimethyl-2-oxopentanoyl)pyrrolidine-2-carbonyl]amino]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[[1-(2-keto-3,3-dimethyl-pentanoyl)prolyl]amino]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C25H34N4O6 MolecularWeight: 486.56066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)NNC(=O)C2CCCN2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)NNC(=O)C2CCCN2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H34N4O6/c1-4-25(2,3)20(30)23(33)28-14-8-12-18(28)21(31)26-27-22(32)19-13-9-15-29(19)24(34)35-16-17-10-6-5-7-11-17/h5-7,10-11,18-19H,4,8-9,12-16H2,1-3H3,(H,26,31)(H,27,32)