methyl 2-(2-methanoylpyrrol-1-yl)-4-methyl-pentanoate

Systemtic Name: methyl 2-(2-methanoylpyrrol-1-yl)-4-methyl-pentanoate Openeye Name: methyl 2-(2-formylpyrrol-1-yl)-4-methyl-pentanoate CAS Name: 2-(2-formyl-1-pyrrolyl)-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-(2-formylpyrrol-1-yl)-4-methylpentanoate Traditional Name: 2-(2-formylpyrrol-1-yl)-4-methyl-valeric acid methyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)N1C=CC=C1C=O

Isomeric SMILES

CC(C)CC(C(=O)OC)N1C=CC=C1C=O

InChI

InChI=1S/C12H17NO3/c1-9(2)7-11(12(15)16-3)13-6-4-5-10(13)8-14/h4-6,8-9,11H,7H2,1-3H3