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

Systemtic Name: 2-[[3,4-bis(oxidanyl)phenyl]methylamino]-N-propyl-propanamide Openeye Name: 2-[(3,4-dihydroxyphenyl)methylamino]-N-propyl-propanamide CAS Name: 2-[(3,4-dihydroxyphenyl)methylamino]-N-propylpropanamide IUPAC Name: 2-[(3,4-dihydroxyphenyl)methylamino]-N-propylpropanamide Traditional Name: N-propyl-2-(protocatechuylamino)propionamide Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NCC1=CC(=C(C=C1)O)O

Isomeric SMILES

CCCNC(=O)C(C)NCC1=CC(=C(C=C1)O)O

InChI

InChI=1S/C13H20N2O3/c1-3-6-14-13(18)9(2)15-8-10-4-5-11(16)12(17)7-10/h4-5,7,9,15-17H,3,6,8H2,1-2H3,(H,14,18)