methyl (5Z)-5-[(4-tert-butylphenyl)methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: methyl (5Z)-5-[(4-tert-butylphenyl)methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: methyl (5Z)-5-[(4-tert-butylphenyl)methylene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: (5Z)-5-[(4-tert-butylphenyl)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl (5Z)-5-[(4-tert-butylphenyl)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5Z)-5-(4-tert-butylbenzylidene)-4-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=CC2=CC=C(C=C2)C(C)(C)C)N1)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)/C(=C/C2=CC=C(C=C2)C(C)(C)C)/N1)C(=O)OC

InChI

InChI=1S/C18H21NO3/c1-11-15(17(21)22-5)16(20)14(19-11)10-12-6-8-13(9-7-12)18(2,3)4/h6-10,19H,1-5H3/b14-10-