5-(2-azanyl-2-oxidanylidene-ethyl)-4-phenyl-benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(2-azanyl-2-oxidanylidene-ethyl)-4-phenyl-benzene-1,3-dicarboxylic acid Openeye Name: 5-(2-amino-2-oxo-ethyl)-4-phenyl-benzene-1,3-dicarboxylic acid CAS Name: 5-(2-amino-2-oxoethyl)-4-phenylbenzene-1,3-dicarboxylic acid IUPAC Name: 5-(2-amino-2-oxoethyl)-4-phenylbenzene-1,3-dicarboxylic acid Traditional Name: 5-(2-amino-2-keto-ethyl)-4-phenyl-isophthalic acid Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2CC(=O)N)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2CC(=O)N)C(=O)O)C(=O)O

InChI

InChI=1S/C16H13NO5/c17-13(18)8-10-6-11(15(19)20)7-12(16(21)22)14(10)9-4-2-1-3-5-9/h1-7H,8H2,(H2,17,18)(H,19,20)(H,21,22)