N-(4-chloranyl-2-nitro-phenyl)-4-(4-methanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-4-(4-methanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-4-(4-formylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(4-chloro-2-nitrophenyl)-4-[(4-formyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-4-(4-formylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-4-(4-formylpiperazino)sulfonyl-benzamide Formula: C18H17ClN4O6S MolecularWeight: 452.86878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C=O)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O6S/c19-14-3-6-16(17(11-14)23(26)27)20-18(25)13-1-4-15(5-2-13)30(28,29)22-9-7-21(12-24)8-10-22/h1-6,11-12H,7-10H2,(H,20,25)