3-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)-4-methyl-benzoate

Systemtic Name: 3-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)-4-methyl-benzoate Openeye Name: 3-(3-formyl-2,5-dimethyl-pyrrol-1-yl)-4-methyl-benzoate CAS Name: 3-(3-formyl-2,5-dimethyl-1-pyrrolyl)-4-methylbenzoate IUPAC Name: 3-(3-formyl-2,5-dimethylpyrrol-1-yl)-4-methylbenzoate Traditional Name: 3-(3-formyl-2,5-dimethyl-pyrrol-1-yl)-4-methyl-benzoate Formula: C15H14NO3- MolecularWeight: 256.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])N2C(=CC(=C2C)C=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])N2C(=CC(=C2C)C=O)C

InChI

InChI=1S/C15H15NO3/c1-9-4-5-12(15(18)19)7-14(9)16-10(2)6-13(8-17)11(16)3/h4-8H,1-3H3,(H,18,19)/p-1