N-(4-butan-2-ylphenyl)adamantane-1-carboxamide

Systemtic Name: N-(4-butan-2-ylphenyl)adamantane-1-carboxamide Openeye Name: N-(4-sec-butylphenyl)adamantane-1-carboxamide CAS Name: N-(4-butan-2-ylphenyl)-1-adamantanecarboxamide IUPAC Name: N-(4-butan-2-ylphenyl)adamantane-1-carboxamide Traditional Name: N-(4-sec-butylphenyl)adamantane-1-carboxamide Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

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