3-methanoyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid

Systemtic Name: 3-methanoyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid Openeye Name: 3-formyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid CAS Name: 3-formyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid IUPAC Name: 3-formyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid Traditional Name: 3-formyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=C1C=CC(=C2)C(=O)O)C=O

Isomeric SMILES

C1CN(CCC2=C1C=CC(=C2)C(=O)O)C=O

InChI

InChI=1S/C12H13NO3/c14-8-13-5-3-9-1-2-11(12(15)16)7-10(9)4-6-13/h1-2,7-8H,3-6H2,(H,15,16)