2-(4-chloranyl-2-methyl-phenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)acetamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-[3-nitro-4-(1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-(3-nitro-4-piperazin-1-ylphenyl)acetamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-(3-nitro-4-piperazino-phenyl)acetamide Formula: C19H21ClN4O4 MolecularWeight: 404.84744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H21ClN4O4/c1-13-10-14(20)2-5-18(13)28-12-19(25)22-15-3-4-16(17(11-15)24(26)27)23-8-6-21-7-9-23/h2-5,10-11,21H,6-9,12H2,1H3,(H,22,25)