1-[3,4-bis(oxidanyl)phenyl]-2-(cyclopentylamino)butan-1-one hydrochloride

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(cyclopentylamino)butan-1-one hydrochloride Openeye Name: 2-(cyclopentylamino)-1-(3,4-dihydroxyphenyl)butan-1-one hydrochloride CAS Name: 2-(cyclopentylamino)-1-(3,4-dihydroxyphenyl)-1-butanone hydrochloride IUPAC Name: 2-(cyclopentylamino)-1-(3,4-dihydroxyphenyl)butan-1-one hydrochloride Traditional Name: 2-(cyclopentylamino)-1-(3,4-dihydroxyphenyl)butan-1-one hydrochloride Formula: C15H22ClNO3 MolecularWeight: 299.79308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC(=C(C=C1)O)O)NC2CCCC2.Cl

Isomeric SMILES

CCC(C(=O)C1=CC(=C(C=C1)O)O)NC2CCCC2.Cl

InChI

InChI=1S/C15H21NO3.ClH/c1-2-12(16-11-5-3-4-6-11)15(19)10-7-8-13(17)14(18)9-10;/h7-9,11-12,16-18H,2-6H2,1H3;1H