2-azanylethanol; 5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid

Systemtic Name: 2-azanylethanol; 5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid Openeye Name: 2-aminoethanol; 5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid CAS Name: 2-aminoethanol; 5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid IUPAC Name: 2-aminoethanol; 5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid Traditional Name: 2-aminoethanol; 5-(3,5-dicarboxyphenyl)isophthalic acid Formula: C18H17NO9 MolecularWeight: 391.32888

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)O)C(=O)O)C2=CC(=CC(=C2)C(=O)O)C(=O)O.C(CO)N

Isomeric SMILES

C1=C(C=C(C=C1C(=O)O)C(=O)O)C2=CC(=CC(=C2)C(=O)O)C(=O)O.C(CO)N

InChI

InChI=1S/C16H10O8.C2H7NO/c17-13(18)9-1-7(2-10(5-9)14(19)20)8-3-11(15(21)22)6-12(4-8)16(23)24;3-1-2-4/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24);4H,1-3H2