(8aR)-3,5,8-tris(chloranyl)-6-oxidanylidene-10-phenylazanyl-8aH-pyren-1-olate

Systemtic Name: (8aR)-3,5,8-tris(chloranyl)-6-oxidanylidene-10-phenylazanyl-8aH-pyren-1-olate Openeye Name: (8aR)-10-anilino-3,5,8-trichloro-6-oxo-8aH-pyren-1-olate CAS Name: (8aR)-10-anilino-3,5,8-trichloro-6-oxo-8aH-pyren-1-olate IUPAC Name: (8aR)-10-anilino-3,5,8-trichloro-6-oxo-8aH-pyren-1-olate Traditional Name: (8aR)-10-anilino-3,5,8-trichloro-6-keto-8aH-pyren-1-olate Formula: C22H11Cl3NO2- MolecularWeight: 427.68724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC3C(=CC(=O)C4=C(C=C5C(=CC(=C2C5=C34)[O-])Cl)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=C[C@H]3C(=CC(=O)C4=C(C=C5C(=CC(=C2C5=C34)[O-])Cl)Cl)Cl

InChI

InChI=1S/C22H12Cl3NO2/c23-13-9-18(28)22-16(26-10-4-2-1-3-5-10)7-12-14(24)8-17(27)21-15(25)6-11(13)20(22)19(12)21/h1-9,12,26,28H/p-1/t12-/m0/s1