3-[(phenylmethyl)amino]-2-propanoyl-cyclohex-2-en-1-one

Systemtic Name: 3-[(phenylmethyl)amino]-2-propanoyl-cyclohex-2-en-1-one Openeye Name: 3-(benzylamino)-2-propanoyl-cyclohex-2-en-1-one CAS Name: 2-(1-oxopropyl)-3-[(phenylmethyl)amino]-1-cyclohex-2-enone IUPAC Name: 3-(benzylamino)-2-propanoylcyclohex-2-en-1-one Traditional Name: 3-(benzylamino)-2-propionyl-cyclohex-2-en-1-one Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(CCCC1=O)NCC2=CC=CC=C2

Isomeric SMILES

CCC(=O)C1=C(CCCC1=O)NCC2=CC=CC=C2

InChI

InChI=1S/C16H19NO2/c1-2-14(18)16-13(9-6-10-15(16)19)17-11-12-7-4-3-5-8-12/h3-5,7-8,17H,2,6,9-11H2,1H3