N-(6bH-acenaphthyleno[1,2-b]quinoxalin-7-ium-7-ylidene)-2-bromanyl-propanamide

Systemtic Name: N-(6bH-acenaphthyleno[1,2-b]quinoxalin-7-ium-7-ylidene)-2-bromanyl-propanamide Openeye Name: N-(6bH-acenaphthyleno[1,2-b]quinoxalin-7-ium-7-ylidene)-2-bromo-propanamide CAS Name: N-(6bH-acenaphthyleno[1,2-b]quinoxalin-7-ium-7-ylidene)-2-bromopropanamide IUPAC Name: N-(6bH-acenaphthyleno[1,2-b]quinoxalin-7-ium-7-ylidene)-2-bromopropanamide Traditional Name: N-(6bH-acenaphtho[1,2-b]quinoxalin-7-ium-7-ylidene)-2-bromo-propionamide Formula: C21H15BrN3O+ MolecularWeight: 405.2673

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N=[N+]1C2C3=CC=CC4=C3C(=CC=C4)C2=NC5=CC=CC=C51)Br

Isomeric SMILES

CC(C(=O)N=[N+]1C2C3=CC=CC4=C3C(=CC=C4)C2=NC5=CC=CC=C51)Br

InChI

InChI=1S/C21H15BrN3O/c1-12(22)21(26)24-25-17-11-3-2-10-16(17)23-19-14-8-4-6-13-7-5-9-15(18(13)14)20(19)25/h2-12,20H,1H3/q+1