(phenylmethyl) N-[1-(2-cyanopyrazolidin-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(2-cyanopyrazolidin-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-(2-cyanopyrazolidine-1-carbonyl)-2-methyl-butyl]carbamate CAS Name: N-[1-(2-cyano-1-pyrazolidinyl)-3-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(2-cyanopyrazolidin-1-yl)-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(2-cyanopyrazolidine-1-carbonyl)-2-methyl-butyl]carbamic acid benzyl ester Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCN1C#N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)N1CCCN1C#N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H24N4O3/c1-3-14(2)16(17(23)22-11-7-10-21(22)13-19)20-18(24)25-12-15-8-5-4-6-9-15/h4-6,8-9,14,16H,3,7,10-12H2,1-2H3,(H,20,24)