(2Z)-2-[[1-[(4-bromophenyl)methyl]pyridin-1-ium-4-yl]methylidene]-3H-pyrrolizin-1-one

Systemtic Name: (2Z)-2-[[1-[(4-bromophenyl)methyl]pyridin-1-ium-4-yl]methylidene]-3H-pyrrolizin-1-one Openeye Name: (2Z)-2-[[1-[(4-bromophenyl)methyl]pyridin-1-ium-4-yl]methylene]-3H-pyrrolizin-1-one CAS Name: (2Z)-2-[[1-[(4-bromophenyl)methyl]-4-pyridin-1-iumyl]methylidene]-3H-pyrrolizin-1-one IUPAC Name: (2Z)-2-[[1-[(4-bromophenyl)methyl]pyridin-1-ium-4-yl]methylidene]-3H-pyrrolizin-1-one Traditional Name: (2Z)-2-[[1-(4-bromobenzyl)pyridin-1-ium-4-yl]methylene]-3H-pyrrolizin-1-one Formula: C20H16BrN2O+ MolecularWeight: 380.25784

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=[N+](C=C2)CC3=CC=C(C=C3)Br)C(=O)C4=CC=CN41

Isomeric SMILES

C1/C(=C/C2=CC=[N+](C=C2)CC3=CC=C(C=C3)Br)/C(=O)C4=CC=CN41

InChI

InChI=1S/C20H16BrN2O/c21-18-5-3-16(4-6-18)13-22-10-7-15(8-11-22)12-17-14-23-9-1-2-19(23)20(17)24/h1-12H,13-14H2/q+1/b17-12-