(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-ethyl-2,5-dimethyl-3-pyrrolecarboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-ethyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H20ClNO4 MolecularWeight: 349.8087

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)C

InChI

InChI=1S/C18H20ClNO4/c1-4-20-11(2)5-16(12(20)3)18(21)23-9-14-7-15(19)6-13-8-22-10-24-17(13)14/h5-7H,4,8-10H2,1-3H3