1-[3,4-bis(oxidanyl)phenyl]-2-(pentylamino)ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(pentylamino)ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-(pentylamino)ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-(pentylamino)ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(pentylamino)ethanone Traditional Name: 2-(amylamino)-1-(3,4-dihydroxyphenyl)ethanone Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC(=O)C1=CC(=C(C=C1)O)O

Isomeric SMILES

CCCCCNCC(=O)C1=CC(=C(C=C1)O)O

InChI

InChI=1S/C13H19NO3/c1-2-3-4-7-14-9-13(17)10-5-6-11(15)12(16)8-10/h5-6,8,14-16H,2-4,7,9H2,1H3