[2-[1-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanylidene-ethyl] 1,5-dimethylpyrrole-2-carboxylate

Systemtic Name: [2-[1-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanylidene-ethyl] 1,5-dimethylpyrrole-2-carboxylate Openeye Name: [2-[1-(1,3-benzodioxol-5-yl)ethylamino]-2-oxo-ethyl] 1,5-dimethylpyrrole-2-carboxylate CAS Name: 1,5-dimethyl-2-pyrrolecarboxylic acid [2-[1-(1,3-benzodioxol-5-yl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(1,3-benzodioxol-5-yl)ethylamino]-2-oxoethyl] 1,5-dimethylpyrrole-2-carboxylate Traditional Name: 1,5-dimethylpyrrole-2-carboxylic acid [2-[1-(1,3-benzodioxol-5-yl)ethylamino]-2-keto-ethyl] ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)C(=O)OCC(=O)NC(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(N1C)C(=O)OCC(=O)NC(C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N2O5/c1-11-4-6-14(20(11)3)18(22)23-9-17(21)19-12(2)13-5-7-15-16(8-13)25-10-24-15/h4-8,12H,9-10H2,1-3H3,(H,19,21)