9-[(phenylmethyl)amino]non-1-yn-3-one

Systemtic Name: 9-[(phenylmethyl)amino]non-1-yn-3-one Openeye Name: 9-(benzylamino)non-1-yn-3-one CAS Name: 9-[(phenylmethyl)amino]-1-nonyn-3-one IUPAC Name: 9-(benzylamino)non-1-yn-3-one Traditional Name: 9-(benzylamino)non-1-yn-3-one Formula: C16H21NO MolecularWeight: 243.34404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC(=O)CCCCCCNCC1=CC=CC=C1

Isomeric SMILES

C#CC(=O)CCCCCCNCC1=CC=CC=C1

InChI

InChI=1S/C16H21NO/c1-2-16(18)12-8-3-4-9-13-17-14-15-10-6-5-7-11-15/h1,5-7,10-11,17H,3-4,8-9,12-14H2