2-azanyl-7-methoxy-8-oxidanyl-3H-1-benzazepine-4-carboxylic acid

Systemtic Name: 2-azanyl-7-methoxy-8-oxidanyl-3H-1-benzazepine-4-carboxylic acid Openeye Name: 2-amino-8-hydroxy-7-methoxy-3H-1-benzazepine-4-carboxylic acid CAS Name: 2-amino-8-hydroxy-7-methoxy-3H-1-benzazepine-4-carboxylic acid IUPAC Name: 2-amino-8-hydroxy-7-methoxy-3H-1-benzazepine-4-carboxylic acid Traditional Name: 2-amino-8-hydroxy-7-methoxy-3H-1-benzazepine-4-carboxylic acid Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(CC(=N2)N)C(=O)O)O

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(CC(=N2)N)C(=O)O)O

InChI

InChI=1S/C12H12N2O4/c1-18-10-3-6-2-7(12(16)17)4-11(13)14-8(6)5-9(10)15/h2-3,5,15H,4H2,1H3,(H2,13,14)(H,16,17)