N-[4-(1-adamantyl)phenyl]-3-cyano-benzamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-3-cyano-benzamide Openeye Name: N-[4-(1-adamantyl)phenyl]-3-cyano-benzamide CAS Name: N-[4-(1-adamantyl)phenyl]-3-cyanobenzamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-3-cyanobenzamide Traditional Name: N-[4-(1-adamantyl)phenyl]-3-cyano-benzamide Formula: C24H24N2O MolecularWeight: 356.46016

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC(=C5)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C24H24N2O/c25-15-16-2-1-3-20(11-16)23(27)26-22-6-4-21(5-7-22)24-12-17-8-18(13-24)10-19(9-17)14-24/h1-7,11,17-19H,8-10,12-14H2,(H,26,27)