N-(2-hexyl-3-propyl-phenyl)-3,3-dimethyl-butanamide

Systemtic Name: N-(2-hexyl-3-propyl-phenyl)-3,3-dimethyl-butanamide Openeye Name: N-(2-hexyl-3-propyl-phenyl)-3,3-dimethyl-butanamide CAS Name: N-(2-hexyl-3-propylphenyl)-3,3-dimethylbutanamide IUPAC Name: N-(2-hexyl-3-propylphenyl)-3,3-dimethylbutanamide Traditional Name: N-(2-hexyl-3-propyl-phenyl)-3,3-dimethyl-butyramide Formula: C21H35NO MolecularWeight: 317.5087

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC=C1NC(=O)CC(C)(C)C)CCC

Isomeric SMILES

CCCCCCC1=C(C=CC=C1NC(=O)CC(C)(C)C)CCC

InChI

InChI=1S/C21H35NO/c1-6-8-9-10-14-18-17(12-7-2)13-11-15-19(18)22-20(23)16-21(3,4)5/h11,13,15H,6-10,12,14,16H2,1-5H3,(H,22,23)