methyl 1-butyl-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl 1-butyl-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-butyl-4-[(2-hydroxyphenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 1-butyl-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-butyl-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: 1-butyl-5-keto-2-methyl-4-salicylidene-2-pyrroline-3-carboxylic acid methyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=CC2=CC=CC=C2O)C1=O)C(=O)OC)C

Isomeric SMILES

CCCCN1C(=C(C(=CC2=CC=CC=C2O)C1=O)C(=O)OC)C

InChI

InChI=1S/C18H21NO4/c1-4-5-10-19-12(2)16(18(22)23-3)14(17(19)21)11-13-8-6-7-9-15(13)20/h6-9,11,20H,4-5,10H2,1-3H3