N-[[2-(aminomethyl)-5-chloranyl-phenyl]methyl]-2-(6-azanylidene-3-cyano-1-oxidanyl-pyridin-2-yl)ethanamide

Systemtic Name: N-[[2-(aminomethyl)-5-chloranyl-phenyl]methyl]-2-(6-azanylidene-3-cyano-1-oxidanyl-pyridin-2-yl)ethanamide Openeye Name: N-[[2-(aminomethyl)-5-chloro-phenyl]methyl]-2-(3-cyano-1-hydroxy-6-imino-2-pyridyl)acetamide CAS Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-(3-cyano-1-hydroxy-6-imino-2-pyridinyl)acetamide IUPAC Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-(3-cyano-1-hydroxy-6-iminopyridin-2-yl)acetamide Traditional Name: N-[2-(aminomethyl)-5-chloro-benzyl]-2-(3-cyano-1-hydroxy-6-imino-2-pyridyl)acetamide Formula: C16H16ClN5O2 MolecularWeight: 345.78354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)CNC(=O)CC2=C(C=CC(=N)N2O)C#N)CN

Isomeric SMILES

C1=CC(=C(C=C1Cl)CNC(=O)CC2=C(C=CC(=N)N2O)C#N)CN

InChI

InChI=1S/C16H16ClN5O2/c17-13-3-1-10(7-18)12(5-13)9-21-16(23)6-14-11(8-19)2-4-15(20)22(14)24/h1-5,20,24H,6-7,9,18H2,(H,21,23)