(E)-[4-(3-methoxyphenyl)-2-oxidanylidene-pyrrolidin-1-yl]-pyridin-2-yl-(2-quinolin-4-ylethylidene)azanium

Systemtic Name: (E)-[4-(3-methoxyphenyl)-2-oxidanylidene-pyrrolidin-1-yl]-pyridin-2-yl-(2-quinolin-4-ylethylidene)azanium Openeye Name: (E)-[4-(3-methoxyphenyl)-2-oxo-pyrrolidin-1-yl]-(2-pyridyl)-[2-(4-quinolyl)ethylidene]ammonium CAS Name: (E)-[4-(3-methoxyphenyl)-2-oxo-1-pyrrolidinyl]-(2-pyridinyl)-[2-(4-quinolinyl)ethylidene]ammonium IUPAC Name: (E)-[4-(3-methoxyphenyl)-2-oxopyrrolidin-1-yl]-pyridin-2-yl-(2-quinolin-4-ylethylidene)azanium Traditional Name: (E)-[2-keto-4-(3-methoxyphenyl)pyrrolidino]-(2-pyridyl)-[2-(4-quinolyl)ethylidene]ammonium Formula: C27H25N4O2+ MolecularWeight: 437.513

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CC(=O)N(C2)[N+](=CCC3=CC=NC4=CC=CC=C34)C5=CC=CC=N5

Isomeric SMILES

COC1=CC=CC(=C1)C2CC(=O)N(C2)/[N+](=C/CC3=CC=NC4=CC=CC=C34)/C5=CC=CC=N5

InChI

InChI=1S/C27H25N4O2/c1-33-23-8-6-7-21(17-23)22-18-27(32)31(19-22)30(26-11-4-5-14-29-26)16-13-20-12-15-28-25-10-3-2-9-24(20)25/h2-12,14-17,22H,13,18-19H2,1H3/q+1/b30-16+