1-[(phenylmethyl)amino]hept-5-yn-2-one

Systemtic Name: 1-[(phenylmethyl)amino]hept-5-yn-2-one Openeye Name: 1-(benzylamino)hept-5-yn-2-one CAS Name: 1-[(phenylmethyl)amino]-5-heptyn-2-one IUPAC Name: 1-(benzylamino)hept-5-yn-2-one Traditional Name: 1-(benzylamino)hept-5-yn-2-one Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCC(=O)CNCC1=CC=CC=C1

Isomeric SMILES

CC#CCCC(=O)CNCC1=CC=CC=C1

InChI

InChI=1S/C14H17NO/c1-2-3-5-10-14(16)12-15-11-13-8-6-4-7-9-13/h4,6-9,15H,5,10-12H2,1H3