N-cyclopropyl-4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-nitro-benzamide Openeye Name: N-cyclopropyl-4-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-nitro-benzamide CAS Name: N-cyclopropyl-4-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-3-nitrobenzamide IUPAC Name: N-cyclopropyl-4-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-nitrobenzamide Traditional Name: N-cyclopropyl-4-[4-(4-ethylbenzoyl)piperazino]-3-nitro-benzamide Formula: C23H26N4O4 MolecularWeight: 422.47694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4/c1-2-16-3-5-17(6-4-16)23(29)26-13-11-25(12-14-26)20-10-7-18(15-21(20)27(30)31)22(28)24-19-8-9-19/h3-7,10,15,19H,2,8-9,11-14H2,1H3,(H,24,28)