[6-chloranyl-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-(6-nitro-1,3-benzothiazol-2-yl)azanium

Systemtic Name: [6-chloranyl-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-(6-nitro-1,3-benzothiazol-2-yl)azanium Openeye Name: [6-chloro-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-(6-nitro-1,3-benzothiazol-2-yl)ammonium CAS Name: [6-chloro-2-(3,4-dimethoxyphenyl)-1-benzopyran-4-ylidene]-(6-nitro-1,3-benzothiazol-2-yl)ammonium IUPAC Name: [6-chloro-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-(6-nitro-1,3-benzothiazol-2-yl)azanium Traditional Name: [6-chloro-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-(6-nitro-1,3-benzothiazol-2-yl)ammonium Formula: C24H17ClN3O5S+ MolecularWeight: 494.92688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=[NH+]C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C5=C(O2)C=CC(=C5)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=[NH+]C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C5=C(O2)C=CC(=C5)Cl)OC

InChI

InChI=1S/C24H16ClN3O5S/c1-31-20-7-3-13(9-22(20)32-2)21-12-18(16-10-14(25)4-8-19(16)33-21)27-24-26-17-6-5-15(28(29)30)11-23(17)34-24/h3-12H,1-2H3/p+1