(4Z)-4-(2-oxidanylideneethylidene)azepane-1-carboxylic acid

Systemtic Name: (4Z)-4-(2-oxidanylideneethylidene)azepane-1-carboxylic acid Openeye Name: (4Z)-4-(2-oxoethylidene)azepane-1-carboxylic acid CAS Name: (4Z)-4-(2-oxoethylidene)-1-azepanecarboxylic acid IUPAC Name: (4Z)-4-(2-oxoethylidene)azepane-1-carboxylic acid Traditional Name: (4Z)-4-(2-ketoethylidene)azepane-1-carboxylic acid Formula: C9H13NO3 MolecularWeight: 183.20442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=O)CCN(C1)C(=O)O

Isomeric SMILES

C1C/C(=C/C=O)/CCN(C1)C(=O)O

InChI

InChI=1S/C9H13NO3/c11-7-4-8-2-1-5-10(6-3-8)9(12)13/h4,7H,1-3,5-6H2,(H,12,13)/b8-4-