N-(4-morpholin-4-ylsulfonylphenyl)-3,5-dinitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(4-morpholin-4-ylsulfonylphenyl)-3,5-dinitro-4-piperidin-1-yl-benzamide Openeye Name: N-(4-morpholinosulfonylphenyl)-3,5-dinitro-4-(1-piperidyl)benzamide CAS Name: N-[4-(4-morpholinylsulfonyl)phenyl]-3,5-dinitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(4-morpholin-4-ylsulfonylphenyl)-3,5-dinitro-4-piperidin-1-ylbenzamide Traditional Name: N-(4-morpholinosulfonylphenyl)-3,5-dinitro-4-piperidino-benzamide Formula: C22H25N5O8S MolecularWeight: 519.5276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O8S/c28-22(23-17-4-6-18(7-5-17)36(33,34)25-10-12-35-13-11-25)16-14-19(26(29)30)21(20(15-16)27(31)32)24-8-2-1-3-9-24/h4-7,14-15H,1-3,8-13H2,(H,23,28)