ethyl 5-[(3-methoxy-4-oxidanyl-phenyl)methyl]-2-methyl-4-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(3-methoxy-4-oxidanyl-phenyl)methyl]-2-methyl-4-oxidanylidene-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(4-hydroxy-3-methoxy-phenyl)methyl]-2-methyl-4-oxo-pyrrole-3-carboxylate CAS Name: 5-[(4-hydroxy-3-methoxyphenyl)methyl]-2-methyl-4-oxo-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-hydroxy-3-methoxyphenyl)methyl]-2-methyl-4-oxopyrrole-3-carboxylate Traditional Name: 4-keto-2-methyl-5-vanillyl-pyrrole-3-carboxylic acid ethyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C1=O)CC2=CC(=C(C=C2)O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C1=O)CC2=CC(=C(C=C2)O)OC)C

InChI

InChI=1S/C16H17NO5/c1-4-22-16(20)14-9(2)17-11(15(14)19)7-10-5-6-12(18)13(8-10)21-3/h5-6,8,18H,4,7H2,1-3H3