N-[2-[2-[(1-diazenylpyridin-1-ium-4-yl)methyl]-5-methoxy-1-benzofuran-3-yl]ethyl]ethanamide

Systemtic Name: N-[2-[2-[(1-diazenylpyridin-1-ium-4-yl)methyl]-5-methoxy-1-benzofuran-3-yl]ethyl]ethanamide Openeye Name: N-[2-[2-[(1-diazenylpyridin-1-ium-4-yl)methyl]-5-methoxy-benzofuran-3-yl]ethyl]acetamide CAS Name: N-[2-[2-[(1-diazenyl-4-pyridin-1-iumyl)methyl]-5-methoxy-3-benzofuranyl]ethyl]acetamide IUPAC Name: N-[2-[2-[(1-diazenylpyridin-1-ium-4-yl)methyl]-5-methoxy-1-benzofuran-3-yl]ethyl]acetamide Traditional Name: N-[2-[2-[(1-diazenylpyridin-1-ium-4-yl)methyl]-5-methoxy-benzofuran-3-yl]ethyl]acetamide Formula: C19H21N4O3+ MolecularWeight: 353.39504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=C(OC2=C1C=C(C=C2)OC)CC3=CC=[N+](C=C3)N=N

Isomeric SMILES

CC(=O)NCCC1=C(OC2=C1C=C(C=C2)OC)CC3=CC=[N+](C=C3)N=N

InChI

InChI=1S/C19H20N4O3/c1-13(24)21-8-5-16-17-12-15(25-2)3-4-18(17)26-19(16)11-14-6-9-23(22-20)10-7-14/h3-4,6-7,9-10,12,20H,5,8,11H2,1-2H3/p+1