2-azanyl-3-[4-(4-nitrophenyl)-1,3-thiazol-3-ium-2-yl]chromen-7-one

Systemtic Name: 2-azanyl-3-[4-(4-nitrophenyl)-1,3-thiazol-3-ium-2-yl]chromen-7-one Openeye Name: 2-amino-3-[4-(4-nitrophenyl)thiazol-3-ium-2-yl]chromen-7-one CAS Name: 2-amino-3-[4-(4-nitrophenyl)-2-thiazol-3-iumyl]-1-benzopyran-7-one IUPAC Name: 2-amino-3-[4-(4-nitrophenyl)-1,3-thiazol-3-ium-2-yl]chromen-7-one Traditional Name: 2-amino-3-[4-(4-nitrophenyl)thiazol-3-ium-2-yl]chromen-7-one Formula: C18H12N3O4S+ MolecularWeight: 366.37058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=[NH+]2)C3=C(OC4=CC(=O)C=CC4=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=[NH+]2)C3=C(OC4=CC(=O)C=CC4=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C18H11N3O4S/c19-17-14(7-11-3-6-13(22)8-16(11)25-17)18-20-15(9-26-18)10-1-4-12(5-2-10)21(23)24/h1-9H,19H2/p+1