2-azanyl-5-oxidanylidene-N-(phenylmethyl)chromeno[2,3-b]pyridin-1-ium-3-carboxamide

Systemtic Name: 2-azanyl-5-oxidanylidene-N-(phenylmethyl)chromeno[2,3-b]pyridin-1-ium-3-carboxamide Openeye Name: 2-amino-N-benzyl-5-oxo-chromeno[2,3-b]pyridin-1-ium-3-carboxamide CAS Name: 2-amino-5-oxo-N-(phenylmethyl)-3-[1]benzopyrano[2,3-b]pyridin-1-iumcarboxamide IUPAC Name: 2-amino-N-benzyl-5-oxochromeno[2,3-b]pyridin-1-ium-3-carboxamide Traditional Name: 2-amino-N-benzyl-5-keto-chromeno[2,3-b]pyridin-1-ium-3-carboxamide Formula: C20H16N3O3+ MolecularWeight: 346.35934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C([NH+]=C3C(=C2)C(=O)C4=CC=CC=C4O3)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C([NH+]=C3C(=C2)C(=O)C4=CC=CC=C4O3)N

InChI

InChI=1S/C20H15N3O3/c21-18-15(19(25)22-11-12-6-2-1-3-7-12)10-14-17(24)13-8-4-5-9-16(13)26-20(14)23-18/h1-10H,11H2,(H2,21,23)(H,22,25)/p+1