[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester IUPAC Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2COC3=CC=CC=C3O2)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OC[C@H]2COC3=CC=CC=C3O2)C

InChI

InChI=1S/C17H17NO5/c1-11(19)12-7-14(18(2)8-12)17(20)22-10-13-9-21-15-5-3-4-6-16(15)23-13/h3-8,13H,9-10H2,1-2H3/t13-/m1/s1