ethyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-2,5-dimethyl-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(N(C(=C1)C)CC(=O)NC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NC2=CC3=C(C=C2)OCO3)C

InChI

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