[2-[(E)-3-(1-benzofuran-2-yl)-3-oxidanylidene-prop-1-enyl]phenyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate

Systemtic Name: [2-[(E)-3-(1-benzofuran-2-yl)-3-oxidanylidene-prop-1-enyl]phenyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Openeye Name: [2-[(E)-3-(benzofuran-2-yl)-3-oxo-prop-1-enyl]phenyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate CAS Name: 2-(1-pyrrolidinyl)-3-pyridinecarboxylic acid [2-[(E)-3-(2-benzofuranyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(1-benzofuran-2-yl)-3-oxoprop-1-enyl]phenyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Traditional Name: 2-pyrrolidinonicotinic acid [2-[(E)-3-(benzofuran-2-yl)-3-keto-prop-1-enyl]phenyl] ester Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=N2)C(=O)OC3=CC=CC=C3C=CC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=N2)C(=O)OC3=CC=CC=C3/C=C/C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C27H22N2O4/c30-22(25-18-20-9-2-4-12-24(20)32-25)14-13-19-8-1-3-11-23(19)33-27(31)21-10-7-15-28-26(21)29-16-5-6-17-29/h1-4,7-15,18H,5-6,16-17H2/b14-13+