methyl (5Z)-2-methyl-5-[(oxidanylamino)methylidene]-4-[2-(phenylmethyl)phenyl]carbonyl-pyrrole-3-carboxylate

Systemtic Name: methyl (5Z)-2-methyl-5-[(oxidanylamino)methylidene]-4-[2-(phenylmethyl)phenyl]carbonyl-pyrrole-3-carboxylate Openeye Name: methyl (5Z)-4-(2-benzylbenzoyl)-5-[(hydroxyamino)methylene]-2-methyl-pyrrole-3-carboxylate CAS Name: (5Z)-5-[(hydroxyamino)methylidene]-2-methyl-4-[oxo-[2-(phenylmethyl)phenyl]methyl]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (5Z)-4-(2-benzylbenzoyl)-5-[(hydroxyamino)methylidene]-2-methylpyrrole-3-carboxylate Traditional Name: (5Z)-4-(2-benzylbenzoyl)-5-[(hydroxyamino)methylene]-2-methyl-pyrrole-3-carboxylic acid methyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CNO)C(=C1C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=CC=C3

Isomeric SMILES

CC1=N/C(=C\NO)/C(=C1C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=CC=C3

InChI

InChI=1S/C22H20N2O4/c1-14-19(22(26)28-2)20(18(24-14)13-23-27)21(25)17-11-7-6-10-16(17)12-15-8-4-3-5-9-15/h3-11,13,23,27H,12H2,1-2H3/b18-13-