N-(4-chloranyl-2-nitro-phenyl)-2-[cyanomethyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-[cyanomethyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl(cyanomethyl)amino]-N-(4-chloro-2-nitro-phenyl)acetamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-[cyanomethyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl(cyanomethyl)amino]-N-(4-chloro-2-nitrophenyl)acetamide Traditional Name: 2-[benzyl(cyanomethyl)amino]-N-(4-chloro-2-nitro-phenyl)acetamide Formula: C17H15ClN4O3 MolecularWeight: 358.779

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC#N)CC(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CC#N)CC(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN4O3/c18-14-6-7-15(16(10-14)22(24)25)20-17(23)12-21(9-8-19)11-13-4-2-1-3-5-13/h1-7,10H,9,11-12H2,(H,20,23)