N-(1-cyanocycloheptyl)-2-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]amino]ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]amino]ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-[2-(2-hydroxyethylamino)-5-nitro-anilino]acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[2-(2-hydroxyethylamino)-5-nitroanilino]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-[2-(2-hydroxyethylamino)-5-nitroanilino]acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[2-(2-hydroxyethylamino)-5-nitro-anilino]acetamide Formula: C18H25N5O4 MolecularWeight: 375.4222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)NC(=O)CNC2=C(C=CC(=C2)[N+](=O)[O-])NCCO

Isomeric SMILES

C1CCCC(CC1)(C#N)NC(=O)CNC2=C(C=CC(=C2)[N+](=O)[O-])NCCO

InChI

InChI=1S/C18H25N5O4/c19-13-18(7-3-1-2-4-8-18)22-17(25)12-21-16-11-14(23(26)27)5-6-15(16)20-9-10-24/h5-6,11,20-21,24H,1-4,7-10,12H2,(H,22,25)