methyl (4Z)-4-[(2-chloranyl-5-nitro-phenyl)methylidene]-1-cyclohexyl-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-4-[(2-chloranyl-5-nitro-phenyl)methylidene]-1-cyclohexyl-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(2-chloro-5-nitro-phenyl)methylene]-1-cyclohexyl-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(2-chloro-5-nitrophenyl)methylidene]-1-cyclohexyl-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(2-chloro-5-nitrophenyl)methylidene]-1-cyclohexyl-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-4-(2-chloro-5-nitro-benzylidene)-1-cyclohexyl-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C20H21ClN2O5 MolecularWeight: 404.84414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)N1C3CCCCC3)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=C(C=CC(=C2)[N+](=O)[O-])Cl)/C(=O)N1C3CCCCC3)C(=O)OC

InChI

InChI=1S/C20H21ClN2O5/c1-12-18(20(25)28-2)16(19(24)22(12)14-6-4-3-5-7-14)11-13-10-15(23(26)27)8-9-17(13)21/h8-11,14H,3-7H2,1-2H3/b16-11-