N,3-bis(4-methylphenyl)adamantane-1-carboxamide

Systemtic Name: N,3-bis(4-methylphenyl)adamantane-1-carboxamide Openeye Name: N,3-bis(p-tolyl)adamantane-1-carboxamide CAS Name: N,3-bis(4-methylphenyl)-1-adamantanecarboxamide IUPAC Name: N,3-bis(4-methylphenyl)adamantane-1-carboxamide Traditional Name: N,3-bis(p-tolyl)adamantane-1-carboxamide Formula: C25H29NO MolecularWeight: 359.50386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NC5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NC5=CC=C(C=C5)C

InChI

InChI=1S/C25H29NO/c1-17-3-7-21(8-4-17)24-12-19-11-20(13-24)15-25(14-19,16-24)23(27)26-22-9-5-18(2)6-10-22/h3-10,19-20H,11-16H2,1-2H3,(H,26,27)