N-[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]phenyl]-1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: N-[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]phenyl]-1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidine-4-carboxamide Openeye Name: N-[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]phenyl]-1-(4-morpholinosulfonyl-2-nitro-phenyl)piperidine-4-carboxamide CAS Name: N-[4-[(2-methyl-5-nitrophenyl)sulfonylamino]phenyl]-1-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-4-piperidinecarboxamide IUPAC Name: N-[4-[(2-methyl-5-nitrophenyl)sulfonylamino]phenyl]-1-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]phenyl]-1-(4-morpholinosulfonyl-2-nitro-phenyl)isonipecotamide Formula: C29H32N6O10S2 MolecularWeight: 688.72858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)NC(=O)C3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)NC(=O)C3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C29H32N6O10S2/c1-20-2-7-24(34(37)38)18-28(20)46(41,42)31-23-5-3-22(4-6-23)30-29(36)21-10-12-32(13-11-21)26-9-8-25(19-27(26)35(39)40)47(43,44)33-14-16-45-17-15-33/h2-9,18-19,21,31H,10-17H2,1H3,(H,30,36)