6,6-bis(azanyl)-3-(phenylmethyl)cyclohexa-2,4-diene-1,1-dicarboxylic acid

Systemtic Name: 6,6-bis(azanyl)-3-(phenylmethyl)cyclohexa-2,4-diene-1,1-dicarboxylic acid Openeye Name: 6,6-diamino-3-benzyl-cyclohexa-2,4-diene-1,1-dicarboxylic acid CAS Name: 6,6-diamino-3-(phenylmethyl)cyclohexa-2,4-diene-1,1-dicarboxylic acid IUPAC Name: 6,6-diamino-3-benzylcyclohexa-2,4-diene-1,1-dicarboxylic acid Traditional Name: 6,6-diamino-3-benzyl-cyclohexa-2,4-diene-1,1-dicarboxylic acid Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(C(C=C2)(N)N)(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(C(C=C2)(N)N)(C(=O)O)C(=O)O

InChI

InChI=1S/C15H16N2O4/c16-15(17)7-6-11(8-10-4-2-1-3-5-10)9-14(15,12(18)19)13(20)21/h1-7,9H,8,16-17H2,(H,18,19)(H,20,21)