methyl 4-(1,3-benzodioxol-5-ylmethylidene)-1-cyclohexyl-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-ylmethylidene)-1-cyclohexyl-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-ylmethylene)-1-cyclohexyl-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethylidene)-1-cyclohexyl-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-ylmethylidene)-1-cyclohexyl-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: 1-cyclohexyl-5-keto-2-methyl-4-piperonylidene-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC3=C(C=C2)OCO3)C(=O)N1C4CCCCC4)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC2=CC3=C(C=C2)OCO3)C(=O)N1C4CCCCC4)C(=O)OC

InChI

InChI=1S/C21H23NO5/c1-13-19(21(24)25-2)16(20(23)22(13)15-6-4-3-5-7-15)10-14-8-9-17-18(11-14)27-12-26-17/h8-11,15H,3-7,12H2,1-2H3