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

Systemtic Name: N-[3-chloranyl-4-(4-ethylpiperazin-1-yl)phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazinyl)phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[3-chloro-4-(4-ethylpiperazino)phenyl]-2-morpholino-5-nitro-benzamide Formula: C23H28ClN5O4 MolecularWeight: 473.95252

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4)Cl

InChI

InChI=1S/C23H28ClN5O4/c1-2-26-7-9-27(10-8-26)22-5-3-17(15-20(22)24)25-23(30)19-16-18(29(31)32)4-6-21(19)28-11-13-33-14-12-28/h3-6,15-16H,2,7-14H2,1H3,(H,25,30)