2-[4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)phenyl]ethanoate

Systemtic Name: 2-[4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)phenyl]ethanoate Openeye Name: 2-[4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)phenyl]acetate CAS Name: 2-[4-(3-formyl-2,5-dimethyl-1-pyrrolyl)phenyl]acetate IUPAC Name: 2-[4-(3-formyl-2,5-dimethylpyrrol-1-yl)phenyl]acetate Traditional Name: 2-[4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)phenyl]acetate Formula: C15H14NO3- MolecularWeight: 256.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)CC(=O)[O-])C)C=O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)CC(=O)[O-])C)C=O

InChI

InChI=1S/C15H15NO3/c1-10-7-13(9-17)11(2)16(10)14-5-3-12(4-6-14)8-15(18)19/h3-7,9H,8H2,1-2H3,(H,18,19)/p-1