2-(3-methyl-8-oxidanylidene-cyclohepta[b]pyrrol-1-yl)ethanoic acid

Systemtic Name: 2-(3-methyl-8-oxidanylidene-cyclohepta[b]pyrrol-1-yl)ethanoic acid Openeye Name: 2-(3-methyl-8-oxo-cyclohepta[b]pyrrol-1-yl)acetic acid CAS Name: 2-(3-methyl-8-oxo-1-cyclohepta[b]pyrrolyl)acetic acid IUPAC Name: 2-(3-methyl-8-oxocyclohepta[b]pyrrol-1-yl)acetic acid Traditional Name: 2-(8-keto-3-methyl-cyclohepta[b]pyrrol-1-yl)acetic acid Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C=CC=CC2=O)CC(=O)O

Isomeric SMILES

CC1=CN(C2=C1C=CC=CC2=O)CC(=O)O

InChI

InChI=1S/C12H11NO3/c1-8-6-13(7-11(15)16)12-9(8)4-2-3-5-10(12)14/h2-6H,7H2,1H3,(H,15,16)