[(1S)-1-(4-chlorophenyl)-3-oxidanylidene-2-benzofuran-1-yl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: [(1S)-1-(4-chlorophenyl)-3-oxidanylidene-2-benzofuran-1-yl]-(pyridin-3-ylmethyl)azanium Openeye Name: [(1S)-1-(4-chlorophenyl)-3-oxo-isobenzofuran-1-yl]-(3-pyridylmethyl)ammonium CAS Name: [(1S)-1-(4-chlorophenyl)-3-oxo-1-isobenzofuranyl]-(3-pyridinylmethyl)ammonium IUPAC Name: [(1S)-1-(4-chlorophenyl)-3-oxo-2-benzofuran-1-yl]-(pyridin-3-ylmethyl)azanium Traditional Name: [(1S)-1-(4-chlorophenyl)-3-keto-phthalan-1-yl]-(3-pyridylmethyl)ammonium Formula: C20H16ClN2O2+ MolecularWeight: 351.80624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)Cl)[NH2+]CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)O[C@]2(C3=CC=C(C=C3)Cl)[NH2+]CC4=CN=CC=C4

InChI

InChI=1S/C20H15ClN2O2/c21-16-9-7-15(8-10-16)20(23-13-14-4-3-11-22-12-14)18-6-2-1-5-17(18)19(24)25-20/h1-12,23H,13H2/p+1/t20-/m0/s1