N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: [[(2R,6R)-2,6-dimethylcyclohexylidene]amino]-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C18H26N4O5S MolecularWeight: 410.48784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

C[C@@H]1CCC[C@H](C1=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C18H26N4O5S/c1-13-4-3-5-14(2)18(13)20-19-16-7-6-15(22(23)24)12-17(16)28(25,26)21-8-10-27-11-9-21/h6-7,12-14,19H,3-5,8-11H2,1-2H3/t13-,14-/m1/s1