7-[(phenylmethyl)amino]heptan-2-one

Systemtic Name: 7-[(phenylmethyl)amino]heptan-2-one Openeye Name: 7-(benzylamino)heptan-2-one CAS Name: 7-[(phenylmethyl)amino]-2-heptanone IUPAC Name: 7-(benzylamino)heptan-2-one Traditional Name: 7-(benzylamino)heptan-2-one Formula: C14H21NO MolecularWeight: 219.32264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCNCC1=CC=CC=C1

Isomeric SMILES

CC(=O)CCCCCNCC1=CC=CC=C1

InChI

InChI=1S/C14H21NO/c1-13(16)8-4-3-7-11-15-12-14-9-5-2-6-10-14/h2,5-6,9-10,15H,3-4,7-8,11-12H2,1H3