methyl 5-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 5-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylate Openeye Name: methyl 5-(3-methoxy-3-oxo-propyl)-1H-pyrrole-2-carboxylate CAS Name: 5-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylate Traditional Name: 5-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid methyl ester Formula: C10H13NO4 MolecularWeight: 211.21452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(N1)C(=O)OC

Isomeric SMILES

COC(=O)CCC1=CC=C(N1)C(=O)OC

InChI

InChI=1S/C10H13NO4/c1-14-9(12)6-4-7-3-5-8(11-7)10(13)15-2/h3,5,11H,4,6H2,1-2H3