N,N-dimethyl-1-[[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]methyl]cycloheptan-1-amine

Systemtic Name: N,N-dimethyl-1-[[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]methyl]cycloheptan-1-amine Openeye Name: N,N-dimethyl-1-[(4-morpholinosulfonyl-2-nitro-anilino)methyl]cycloheptanamine CAS Name: N,N-dimethyl-1-[[4-(4-morpholinylsulfonyl)-2-nitroanilino]methyl]-1-cycloheptanamine IUPAC Name: N,N-dimethyl-1-[(4-morpholin-4-ylsulfonyl-2-nitroanilino)methyl]cycloheptan-1-amine Traditional Name: dimethyl-[1-[(4-morpholinosulfonyl-2-nitro-anilino)methyl]cycloheptyl]amine Formula: C20H32N4O5S MolecularWeight: 440.55688

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCCC1)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1(CCCCCC1)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H32N4O5S/c1-22(2)20(9-5-3-4-6-10-20)16-21-18-8-7-17(15-19(18)24(25)26)30(27,28)23-11-13-29-14-12-23/h7-8,15,21H,3-6,9-14,16H2,1-2H3