ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(piperonylcarbamoyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C18H20N2O5/c1-4-23-18(22)15-10(2)16(20-11(15)3)17(21)19-8-12-5-6-13-14(7-12)25-9-24-13/h5-7,20H,4,8-9H2,1-3H3,(H,19,21)