methyl 2-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]ethanoate

Systemtic Name: methyl 2-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]ethanoate Openeye Name: methyl 2-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)acetate CAS Name: 2-(3-benzoyl-2,5-dimethyl-1-pyrrolyl)acetic acid methyl ester IUPAC Name: methyl 2-(3-benzoyl-2,5-dimethylpyrrol-1-yl)acetate Traditional Name: 2-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)acetic acid methyl ester Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC(=O)OC)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(N1CC(=O)OC)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO3/c1-11-9-14(12(2)17(11)10-15(18)20-3)16(19)13-7-5-4-6-8-13/h4-9H,10H2,1-3H3