(3R,5S)-3,5-dimethyl-N-(4-nitrophenyl)adamantane-1-carboxamide

Systemtic Name: (3R,5S)-3,5-dimethyl-N-(4-nitrophenyl)adamantane-1-carboxamide Openeye Name: (3R,5S)-3,5-dimethyl-N-(4-nitrophenyl)adamantane-1-carboxamide CAS Name: (3R,5S)-3,5-dimethyl-N-(4-nitrophenyl)-1-adamantanecarboxamide IUPAC Name: (3R,5S)-3,5-dimethyl-N-(4-nitrophenyl)adamantane-1-carboxamide Traditional Name: (3R,5S)-3,5-dimethyl-N-(4-nitrophenyl)adamantane-1-carboxamide Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C19H24N2O3/c1-17-7-13-8-18(2,10-17)12-19(9-13,11-17)16(22)20-14-3-5-15(6-4-14)21(23)24/h3-6,13H,7-12H2,1-2H3,(H,20,22)/t13?,17-,18+,19?