7-methoxy-3-(5-nitro-1,3-thiazol-2-yl)-4aH-quinazolin-3-ium-4-one

Systemtic Name: 7-methoxy-3-(5-nitro-1,3-thiazol-2-yl)-4aH-quinazolin-3-ium-4-one Openeye Name: 7-methoxy-3-(5-nitrothiazol-2-yl)-4aH-quinazolin-3-ium-4-one CAS Name: 7-methoxy-3-(5-nitro-2-thiazolyl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 7-methoxy-3-(5-nitro-1,3-thiazol-2-yl)-4aH-quinazolin-3-ium-4-one Traditional Name: 7-methoxy-3-(5-nitrothiazol-2-yl)-4aH-quinazolin-3-ium-4-one Formula: C12H9N4O4S+ MolecularWeight: 305.28926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC=[N+](C(=O)C2C=C1)C3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=NC=[N+](C(=O)C2C=C1)C3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N4O4S/c1-20-7-2-3-8-9(4-7)14-6-15(11(8)17)12-13-5-10(21-12)16(18)19/h2-6,8H,1H3/q+1