2-(3-ethyl-2-oxidanylidene-cyclohepta[b]pyrrol-1-yl)ethanoic acid

Systemtic Name: 2-(3-ethyl-2-oxidanylidene-cyclohepta[b]pyrrol-1-yl)ethanoic acid Openeye Name: 2-(3-ethyl-2-oxo-cyclohepta[b]pyrrol-1-yl)acetic acid CAS Name: 2-(3-ethyl-2-oxo-1-cyclohepta[b]pyrrolyl)acetic acid IUPAC Name: 2-(3-ethyl-2-oxocyclohepta[b]pyrrol-1-yl)acetic acid Traditional Name: 2-(3-ethyl-2-keto-cyclohepta[b]pyrrol-1-yl)acetic acid Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC=CC=C2N(C1=O)CC(=O)O

Isomeric SMILES

CCC1=C2C=CC=CC=C2N(C1=O)CC(=O)O

InChI

InChI=1S/C13H13NO3/c1-2-9-10-6-4-3-5-7-11(10)14(13(9)17)8-12(15)16/h3-7H,2,8H2,1H3,(H,15,16)