5-(1-benzofuran-2-yl)-2-methyl-1-(2-methylpropyl)pyrrole-3-carboxylate

Systemtic Name: 5-(1-benzofuran-2-yl)-2-methyl-1-(2-methylpropyl)pyrrole-3-carboxylate Openeye Name: 5-(benzofuran-2-yl)-1-isobutyl-2-methyl-pyrrole-3-carboxylate CAS Name: 5-(2-benzofuranyl)-2-methyl-1-(2-methylpropyl)-3-pyrrolecarboxylate IUPAC Name: 5-(1-benzofuran-2-yl)-2-methyl-1-(2-methylpropyl)pyrrole-3-carboxylate Traditional Name: 5-(benzofuran-2-yl)-1-isobutyl-2-methyl-pyrrole-3-carboxylate Formula: C18H18NO3- MolecularWeight: 296.34042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC(C)C)C2=CC3=CC=CC=C3O2)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(N1CC(C)C)C2=CC3=CC=CC=C3O2)C(=O)[O-]

InChI

InChI=1S/C18H19NO3/c1-11(2)10-19-12(3)14(18(20)21)9-15(19)17-8-13-6-4-5-7-16(13)22-17/h4-9,11H,10H2,1-3H3,(H,20,21)/p-1