4-chloranyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-[4-(4-methyl-1-piperazinyl)phenyl]propyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[3-[4-(4-methylpiperazino)phenyl]propyl]-3-nitro-benzamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)CCCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)CCCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H25ClN4O3/c1-24-11-13-25(14-12-24)18-7-4-16(5-8-18)3-2-10-23-21(27)17-6-9-19(22)20(15-17)26(28)29/h4-9,15H,2-3,10-14H2,1H3,(H,23,27)