N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-2-methoxy-5-nitro-benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-2-methoxy-5-nitro-benzamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-2-methoxy-5-nitro-benzamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-2-methoxy-5-nitrobenzamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-2-methoxy-5-nitrobenzamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-2-methoxy-5-nitro-benzamide Formula: C21H26N4O4 MolecularWeight: 398.45554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC)C

InChI

InChI=1S/C21H26N4O4/c1-4-23-9-11-24(12-10-23)19-7-5-16(13-15(19)2)22-21(26)18-14-17(25(27)28)6-8-20(18)29-3/h5-8,13-14H,4,9-12H2,1-3H3,(H,22,26)