2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanoic acid; 1-pyridin-2-ylpiperazine

Systemtic Name: 2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanoic acid; 1-pyridin-2-ylpiperazine Openeye Name: 2-amino-3-(3,4-dihydroxyphenyl)propanoic acid; 1-(2-pyridyl)piperazine CAS Name: 2-amino-3-(3,4-dihydroxyphenyl)propanoic acid; 1-(2-pyridinyl)piperazine IUPAC Name: 2-amino-3-(3,4-dihydroxyphenyl)propanoic acid; 1-pyridin-2-ylpiperazine Traditional Name: 2-amino-3-(3,4-dihydroxyphenyl)propionic acid; 1-(2-pyridyl)piperazine Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC=N2.C1=CC(=C(C=C1CC(C(=O)O)N)O)O

Isomeric SMILES

C1CN(CCN1)C2=CC=CC=N2.C1=CC(=C(C=C1CC(C(=O)O)N)O)O

InChI

InChI=1S/C9H13N3.C9H11NO4/c1-2-4-11-9(3-1)12-7-5-10-6-8-12;10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-4,10H,5-8H2;1-2,4,6,11-12H,3,10H2,(H,13,14)