1-(azepan-1-yl)-2-tert-butyl-4,4-dimethyl-pentan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-tert-butyl-4,4-dimethyl-pentan-1-one Openeye Name: 1-(azepan-1-yl)-2-tert-butyl-4,4-dimethyl-pentan-1-one CAS Name: 1-(1-azepanyl)-2-tert-butyl-4,4-dimethyl-1-pentanone IUPAC Name: 1-(azepan-1-yl)-2-tert-butyl-4,4-dimethylpentan-1-one Traditional Name: 1-(azepan-1-yl)-2-tert-butyl-4,4-dimethyl-pentan-1-one Formula: C17H33NO MolecularWeight: 267.45002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)N1CCCCCC1)C(C)(C)C

Isomeric SMILES

CC(C)(C)CC(C(=O)N1CCCCCC1)C(C)(C)C

InChI

InChI=1S/C17H33NO/c1-16(2,3)13-14(17(4,5)6)15(19)18-11-9-7-8-10-12-18/h14H,7-13H2,1-6H3