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3-[(5-carboxyfuran-2-yl)methylamino]phthalic acid

3-[(5-carboxyfuran-2-yl)methylamino]phthalic acid

Systemtic Name:3-[(5-carboxyfuran-2-yl)methylamino]phthalic acid
Openeye Name:3-[(5-carboxy-2-furyl)methylamino]phthalic acid
CAS Name:3-[(5-carboxy-2-furanyl)methylamino]phthalic acid
IUPAC Name:3-[(5-carboxyfuran-2-yl)methylamino]phthalic acid
Traditional Name:3-[(5-carboxy-2-furyl)methylamino]phthalic acid
Formula: C14H11NO7
MolecularWeight: 305.23964
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)NCC2=CC=C(O2)C(=O)O)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC(=C(C(=C1)NCC2=CC=C(O2)C(=O)O)C(=O)O)C(=O)O


InChI

InChI=1S/C14H11NO7/c16-12(17)8-2-1-3-9(11(8)14(20)21)15-6-7-4-5-10(22-7)13(18)19/h1-5,15H,6H2,(H,16,17)(H,18,19)(H,20,21)


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