3,5-bis(azanyl)benzoic acid; (E)-3-phenylprop-2-enoic acid

Systemtic Name: 3,5-bis(azanyl)benzoic acid; (E)-3-phenylprop-2-enoic acid Openeye Name: 3,5-diaminobenzoic acid; (E)-3-phenylprop-2-enoic acid CAS Name: 3,5-diaminobenzoic acid; (E)-3-phenyl-2-propenoic acid IUPAC Name: 3,5-diaminobenzoic acid; (E)-3-phenylprop-2-enoic acid Traditional Name: 3,5-diaminobenzoic acid; (E)-3-phenylacrylic acid Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)O.C1=C(C=C(C=C1N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)O.C1=C(C=C(C=C1N)N)C(=O)O

InChI

InChI=1S/C9H8O2.C7H8N2O2/c10-9(11)7-6-8-4-2-1-3-5-8;8-5-1-4(7(10)11)2-6(9)3-5/h1-7H,(H,10,11);1-3H,8-9H2,(H,10,11)/b7-6+;