N-butyl-3-ethynyl-N-propan-2-yl-benzamide

Systemtic Name: N-butyl-3-ethynyl-N-propan-2-yl-benzamide Openeye Name: N-butyl-3-ethynyl-N-isopropyl-benzamide CAS Name: N-butyl-3-ethynyl-N-propan-2-ylbenzamide IUPAC Name: N-butyl-3-ethynyl-N-propan-2-ylbenzamide Traditional Name: N-butyl-3-ethynyl-N-isopropyl-benzamide Formula: C16H21NO MolecularWeight: 243.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C)C(=O)C1=CC=CC(=C1)C#C

Isomeric SMILES

CCCCN(C(C)C)C(=O)C1=CC=CC(=C1)C#C

InChI

InChI=1S/C16H21NO/c1-5-7-11-17(13(3)4)16(18)15-10-8-9-14(6-2)12-15/h2,8-10,12-13H,5,7,11H2,1,3-4H3