2-chloranyl-4-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide Openeye Name: 2-chloro-4-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide CAS Name: 2-chloro-4-nitro-N-[4-[4-(1-oxopentyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide Traditional Name: 2-chloro-4-nitro-N-[4-(4-valerylpiperazino)phenyl]benzamide Formula: C22H25ClN4O4 MolecularWeight: 444.9113

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H25ClN4O4/c1-2-3-4-21(28)26-13-11-25(12-14-26)17-7-5-16(6-8-17)24-22(29)19-10-9-18(27(30)31)15-20(19)23/h5-10,15H,2-4,11-14H2,1H3,(H,24,29)