4-chloranyl-N-[(3R,5S)-3,5-dimethyl-1-adamantyl]benzamide

Systemtic Name: 4-chloranyl-N-[(3R,5S)-3,5-dimethyl-1-adamantyl]benzamide Openeye Name: 4-chloro-N-[(3R,5S)-3,5-dimethyl-1-adamantyl]benzamide CAS Name: 4-chloro-N-[(3R,5S)-3,5-dimethyl-1-adamantyl]benzamide IUPAC Name: 4-chloro-N-[(3R,5S)-3,5-dimethyl-1-adamantyl]benzamide Traditional Name: 4-chloro-N-[(3R,5S)-3,5-dimethyl-1-adamantyl]benzamide Formula: C19H24ClNO MolecularWeight: 317.85296

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)NC(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C19H24ClNO/c1-17-7-13-8-18(2,10-17)12-19(9-13,11-17)21-16(22)14-3-5-15(20)6-4-14/h3-6,13H,7-12H2,1-2H3,(H,21,22)/t13?,17-,18+,19?