3-nitro-N-[2-[4-(3-nitrophenyl)carbonylpiperazin-1-yl]sulfonylethyl]benzamide

Systemtic Name: 3-nitro-N-[2-[4-(3-nitrophenyl)carbonylpiperazin-1-yl]sulfonylethyl]benzamide Openeye Name: 3-nitro-N-[2-[4-(3-nitrobenzoyl)piperazin-1-yl]sulfonylethyl]benzamide CAS Name: 3-nitro-N-[2-[[4-[(3-nitrophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 3-nitro-N-[2-[4-(3-nitrobenzoyl)piperazin-1-yl]sulfonylethyl]benzamide Traditional Name: 3-nitro-N-[2-[4-(3-nitrobenzoyl)piperazino]sulfonylethyl]benzamide Formula: C20H21N5O8S MolecularWeight: 491.47444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O8S/c26-19(15-3-1-5-17(13-15)24(28)29)21-7-12-34(32,33)23-10-8-22(9-11-23)20(27)16-4-2-6-18(14-16)25(30)31/h1-6,13-14H,7-12H2,(H,21,26)