[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]-piperidin-1-yl-methanone

Systemtic Name: [(5S,7R)-3-(4-methylphenyl)-1-adamantyl]-piperidin-1-yl-methanone Openeye Name: 1-piperidyl-[(5S,7R)-3-(p-tolyl)-1-adamantyl]methanone CAS Name: [(5S,7R)-3-(4-methylphenyl)-1-adamantyl]-(1-piperidinyl)methanone IUPAC Name: [(5S,7R)-3-(4-methylphenyl)-1-adamantyl]-piperidin-1-ylmethanone Traditional Name: piperidino-[(5S,7R)-3-(p-tolyl)-1-adamantyl]methanone Formula: C23H31NO MolecularWeight: 337.49834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)C(=O)N5CCCCC5

InChI

InChI=1S/C23H31NO/c1-17-5-7-20(8-6-17)22-12-18-11-19(13-22)15-23(14-18,16-22)21(25)24-9-3-2-4-10-24/h5-8,18-19H,2-4,9-16H2,1H3/t18-,19+,22?,23?