2-[[3,4-bis(oxidanyl)phenyl]methylamino]-N-propyl-ethanamide

Systemtic Name: 2-[[3,4-bis(oxidanyl)phenyl]methylamino]-N-propyl-ethanamide Openeye Name: 2-[(3,4-dihydroxyphenyl)methylamino]-N-propyl-acetamide CAS Name: 2-[(3,4-dihydroxyphenyl)methylamino]-N-propylacetamide IUPAC Name: 2-[(3,4-dihydroxyphenyl)methylamino]-N-propylacetamide Traditional Name: N-propyl-2-(protocatechuylamino)acetamide Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNCC1=CC(=C(C=C1)O)O

Isomeric SMILES

CCCNC(=O)CNCC1=CC(=C(C=C1)O)O

InChI

InChI=1S/C12H18N2O3/c1-2-5-14-12(17)8-13-7-9-3-4-10(15)11(16)6-9/h3-4,6,13,15-16H,2,5,7-8H2,1H3,(H,14,17)