(2R)-2-(1-adamantylamino)-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: (2R)-2-(1-adamantylamino)-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Openeye Name: (2R)-2-(1-adamantylamino)-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide CAS Name: (2R)-2-(1-adamantylamino)-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide IUPAC Name: (2R)-2-(1-adamantylamino)-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Traditional Name: (2R)-2-(1-adamantylamino)-N-[4-nitro-2-(trifluoromethyl)phenyl]propionamide Formula: C20H24F3N3O3 MolecularWeight: 411.41807

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H24F3N3O3/c1-11(25-19-8-12-4-13(9-19)6-14(5-12)10-19)18(27)24-17-3-2-15(26(28)29)7-16(17)20(21,22)23/h2-3,7,11-14,25H,4-6,8-10H2,1H3,(H,24,27)/t11-,12?,13?,14?,19?/m1/s1