N-[4-[6-azanyl-5-cyano-4-(furan-2-yl)pyridin-1-ium-2-yl]-2-bromanyl-phenyl]ethanamide

Systemtic Name: N-[4-[6-azanyl-5-cyano-4-(furan-2-yl)pyridin-1-ium-2-yl]-2-bromanyl-phenyl]ethanamide Openeye Name: N-[4-[6-amino-5-cyano-4-(2-furyl)pyridin-1-ium-2-yl]-2-bromo-phenyl]acetamide CAS Name: N-[4-[6-amino-5-cyano-4-(2-furanyl)-2-pyridin-1-iumyl]-2-bromophenyl]acetamide IUPAC Name: N-[4-[6-amino-5-cyano-4-(furan-2-yl)pyridin-1-ium-2-yl]-2-bromophenyl]acetamide Traditional Name: N-[4-[6-amino-5-cyano-4-(2-furyl)pyridin-1-ium-2-yl]-2-bromo-phenyl]acetamide Formula: C18H14BrN4O2+ MolecularWeight: 398.23336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC=CO3)C#N)N)Br

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC=CO3)C#N)N)Br

InChI

InChI=1S/C18H13BrN4O2/c1-10(24)22-15-5-4-11(7-14(15)19)16-8-12(17-3-2-6-25-17)13(9-20)18(21)23-16/h2-8H,1H3,(H2,21,23)(H,22,24)/p+1