methyl 3-(4-chloranylbutoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 3-(4-chloranylbutoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 3-(4-chlorobutoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 3-(4-chlorobutoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-chlorobutoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 3-(4-chlorobutoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C12H18ClNO3 MolecularWeight: 259.72922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1OCCCCCl)C(=O)OC)C

Isomeric SMILES

CC1=C(NC(=C1OCCCCCl)C(=O)OC)C

InChI

InChI=1S/C12H18ClNO3/c1-8-9(2)14-10(12(15)16-3)11(8)17-7-5-4-6-13/h14H,4-7H2,1-3H3