2-[1,3-bis(oxidanylidene)-2H-pyrrolo[3,4-h]quinolin-1-ium-2-yl]-2,3-dimethyl-butanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)-2H-pyrrolo[3,4-h]quinolin-1-ium-2-yl]-2,3-dimethyl-butanamide Openeye Name: 2-(1,3-dioxo-2H-pyrrolo[3,4-h]quinolin-1-ium-2-yl)-2,3-dimethyl-butanamide CAS Name: 2-(1,3-dioxo-2H-pyrrolo[3,4-h]quinolin-1-ium-2-yl)-2,3-dimethylbutanamide IUPAC Name: 2-(1,3-dioxo-2H-pyrrolo[3,4-h]quinolin-1-ium-2-yl)-2,3-dimethylbutanamide Traditional Name: 2-(1,3-diketo-2H-pyrrolo[3,4-h]quinolin-1-ium-2-yl)-2,3-dimethyl-butyramide Formula: C17H18N3O3+ MolecularWeight: 312.34312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C1C(=O)C=C2C=CC3=CN=CC3=C2[N+]1=O)C(=O)N

Isomeric SMILES

CC(C)C(C)(C1C(=O)C=C2C=CC3=CN=CC3=C2[N+]1=O)C(=O)N

InChI

InChI=1S/C17H17N3O3/c1-9(2)17(3,16(18)22)15-13(21)6-10-4-5-11-7-19-8-12(11)14(10)20(15)23/h4-9,15H,1-3H3,(H-,18,22)/p+1