2-[(1,5-dimethylpyrrol-2-yl)methyl]-3-oxidanylidene-1H-isoindole-1-carboxylic acid

Systemtic Name: 2-[(1,5-dimethylpyrrol-2-yl)methyl]-3-oxidanylidene-1H-isoindole-1-carboxylic acid Openeye Name: 2-[(1,5-dimethylpyrrol-2-yl)methyl]-3-oxo-isoindoline-1-carboxylic acid CAS Name: 2-[(1,5-dimethyl-2-pyrrolyl)methyl]-3-oxo-1H-isoindole-1-carboxylic acid IUPAC Name: 2-[(1,5-dimethylpyrrol-2-yl)methyl]-3-oxo-1H-isoindole-1-carboxylic acid Traditional Name: 2-[(1,5-dimethylpyrrol-2-yl)methyl]-3-keto-isoindoline-1-carboxylic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)CN2C(C3=CC=CC=C3C2=O)C(=O)O

Isomeric SMILES

CC1=CC=C(N1C)CN2C(C3=CC=CC=C3C2=O)C(=O)O

InChI

InChI=1S/C16H16N2O3/c1-10-7-8-11(17(10)2)9-18-14(16(20)21)12-5-3-4-6-13(12)15(18)19/h3-8,14H,9H2,1-2H3,(H,20,21)