[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-benzamidopropanoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-benzamidopropanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 2-benzamidopropanoate CAS Name: 2-benzamidopropanoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-benzamidopropanoate Traditional Name: 2-benzamidopropionic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1(CCCC1)C#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)OCC(=O)NC1(CCCC1)C#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3O4/c1-13(20-16(23)14-7-3-2-4-8-14)17(24)25-11-15(22)21-18(12-19)9-5-6-10-18/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,20,23)(H,21,22)