ethyl 4-[(2-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(2-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: ethyl 1-isobutyl-4-[(2-methoxyphenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 4-[(2-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxopyrrole-3-carboxylate Traditional Name: 1-isobutyl-5-keto-2-methyl-4-o-anisylidene-2-pyrroline-3-carboxylic acid ethyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=CC=C2OC)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=CC=C2OC)CC(C)C)C

InChI

InChI=1S/C20H25NO4/c1-6-25-20(23)18-14(4)21(12-13(2)3)19(22)16(18)11-15-9-7-8-10-17(15)24-5/h7-11,13H,6,12H2,1-5H3