N-[2-(4-methyl-7-oxidanylidene-1,2-benzoxazin-2-ium-2-yl)ethyl]pyridine-4-carboxamide

Systemtic Name: N-[2-(4-methyl-7-oxidanylidene-1,2-benzoxazin-2-ium-2-yl)ethyl]pyridine-4-carboxamide Openeye Name: N-[2-(4-methyl-7-oxo-1,2-benzoxazin-2-ium-2-yl)ethyl]pyridine-4-carboxamide CAS Name: N-[2-(4-methyl-7-oxo-1,2-benzoxazin-2-ium-2-yl)ethyl]-4-pyridinecarboxamide IUPAC Name: N-[2-(4-methyl-7-oxo-1,2-benzoxazin-2-ium-2-yl)ethyl]pyridine-4-carboxamide Traditional Name: N-[2-(7-keto-4-methyl-1,2-benzoxazin-2-ium-2-yl)ethyl]isonicotinamide Formula: C17H16N3O3+ MolecularWeight: 310.32724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=O)C=C2O[N+](=C1)CCNC(=O)C3=CC=NC=C3

Isomeric SMILES

CC1=C2C=CC(=O)C=C2O[N+](=C1)CCNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C17H15N3O3/c1-12-11-20(23-16-10-14(21)2-3-15(12)16)9-8-19-17(22)13-4-6-18-7-5-13/h2-7,10-11H,8-9H2,1H3/p+1