N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-2,6-dinitro-aniline

Systemtic Name: N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-2,6-dinitro-aniline Openeye Name: N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-2,6-dinitro-aniline CAS Name: N-[4-[(2R,6R)-2,6-dimethyl-4-morpholinyl]phenyl]-2,6-dinitroaniline IUPAC Name: N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-2,6-dinitroaniline Traditional Name: [4-[(2R,6R)-2,6-dimethylmorpholino]phenyl]-(2,6-dinitrophenyl)amine Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=CC=C(C=C2)NC3=C(C=CC=C3[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)C2=CC=C(C=C2)NC3=C(C=CC=C3[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5/c1-12-10-20(11-13(2)27-12)15-8-6-14(7-9-15)19-18-16(21(23)24)4-3-5-17(18)22(25)26/h3-9,12-13,19H,10-11H2,1-2H3/t12-,13-/m1/s1