N-[(5-ethanoyl-1-benzofuran-2-yl)methyl]-3-methyl-4-oxidanidyl-quinoxalin-4-ium-2-carboxamide

Systemtic Name: N-[(5-ethanoyl-1-benzofuran-2-yl)methyl]-3-methyl-4-oxidanidyl-quinoxalin-4-ium-2-carboxamide Openeye Name: N-[(5-acetylbenzofuran-2-yl)methyl]-3-methyl-4-oxido-quinoxalin-4-ium-2-carboxamide CAS Name: N-[(5-acetyl-2-benzofuranyl)methyl]-3-methyl-4-oxido-2-quinoxalin-4-iumcarboxamide IUPAC Name: N-[(5-acetyl-1-benzofuran-2-yl)methyl]-3-methyl-4-oxidoquinoxalin-4-ium-2-carboxamide Traditional Name: N-[(5-acetylbenzofuran-2-yl)methyl]-3-methyl-4-oxido-quinoxalin-4-ium-2-carboxamide Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N=C1C(=O)NCC3=CC4=C(O3)C=CC(=C4)C(=O)C)[O-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N=C1C(=O)NCC3=CC4=C(O3)C=CC(=C4)C(=O)C)[O-]

InChI

InChI=1S/C21H17N3O4/c1-12-20(23-17-5-3-4-6-18(17)24(12)27)21(26)22-11-16-10-15-9-14(13(2)25)7-8-19(15)28-16/h3-10H,11H2,1-2H3,(H,22,26)