N-[1-(cyanomethylamino)-1-oxidanylidene-hex-4-yn-2-yl]benzamide

Systemtic Name: N-[1-(cyanomethylamino)-1-oxidanylidene-hex-4-yn-2-yl]benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)pent-3-ynyl]benzamide CAS Name: N-[1-(cyanomethylamino)-1-oxohex-4-yn-2-yl]benzamide IUPAC Name: N-[1-(cyanomethylamino)-1-oxohex-4-yn-2-yl]benzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)pent-3-ynyl]benzamide Formula: C15H15N3O2 MolecularWeight: 269.2985

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C(=O)NCC#N)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CC#CCC(C(=O)NCC#N)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H15N3O2/c1-2-3-9-13(15(20)17-11-10-16)18-14(19)12-7-5-4-6-8-12/h4-8,13H,9,11H2,1H3,(H,17,20)(H,18,19)