N-(5-chloranyl-2-cyano-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylamino]ethanamide; ethanedioic acid

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylamino]ethanamide; ethanedioic acid Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylamino]acetamide; oxalic acid CAS Name: N-(5-chloro-2-cyanophenyl)-2-[(1-ethyl-2-pyrrolidinyl)methylamino]acetamide; oxalic acid IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-[(1-ethylpyrrolidin-2-yl)methylamino]acetamide; oxalic acid Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylamino]acetamide; oxalic acid Formula: C18H23ClN4O5 MolecularWeight: 410.85202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNCC(=O)NC2=C(C=CC(=C2)Cl)C#N.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCCC1CNCC(=O)NC2=C(C=CC(=C2)Cl)C#N.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H21ClN4O.C2H2O4/c1-2-21-7-3-4-14(21)10-19-11-16(22)20-15-8-13(17)6-5-12(15)9-18;3-1(4)2(5)6/h5-6,8,14,19H,2-4,7,10-11H2,1H3,(H,20,22);(H,3,4)(H,5,6)