(phenylmethyl) 2-[2-(3-methylbutanoylamino)ethanoyl]pyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-(3-methylbutanoylamino)ethanoyl]pyrazolidine-1-carboxylate Openeye Name: benzyl 2-[2-(3-methylbutanoylamino)acetyl]pyrazolidine-1-carboxylate CAS Name: 2-[2-[(3-methyl-1-oxobutyl)amino]-1-oxoethyl]-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(3-methylbutanoylamino)acetyl]pyrazolidine-1-carboxylate Traditional Name: 2-[2-(isovalerylamino)acetyl]pyrazolidine-1-carboxylic acid benzyl ester Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCC(=O)N1CCCN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)NCC(=O)N1CCCN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O4/c1-14(2)11-16(22)19-12-17(23)20-9-6-10-21(20)18(24)25-13-15-7-4-3-5-8-15/h3-5,7-8,14H,6,9-13H2,1-2H3,(H,19,22)