N-[[3-(4-methylphenyl)-1-adamantyl]methyl]propanamide

Systemtic Name: N-[[3-(4-methylphenyl)-1-adamantyl]methyl]propanamide Openeye Name: N-[[3-(p-tolyl)-1-adamantyl]methyl]propanamide CAS Name: N-[[3-(4-methylphenyl)-1-adamantyl]methyl]propanamide IUPAC Name: N-[[3-(4-methylphenyl)-1-adamantyl]methyl]propanamide Traditional Name: N-[[3-(p-tolyl)-1-adamantyl]methyl]propionamide Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCC12CC3CC(C1)CC(C3)(C2)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(=O)NCC12CC3CC(C1)CC(C3)(C2)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H29NO/c1-3-19(23)22-14-20-9-16-8-17(10-20)12-21(11-16,13-20)18-6-4-15(2)5-7-18/h4-7,16-17H,3,8-14H2,1-2H3,(H,22,23)