N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)phenyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[4-(4-ethylpiperazino)phenyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C25H33N5O3 MolecularWeight: 451.56122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCCC(C4)C)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCCC(C4)C)[N+](=O)[O-]

InChI

InChI=1S/C25H33N5O3/c1-3-27-13-15-28(16-14-27)22-9-7-21(8-10-22)26-25(31)20-6-11-23(24(17-20)30(32)33)29-12-4-5-19(2)18-29/h6-11,17,19H,3-5,12-16,18H2,1-2H3,(H,26,31)