(4-chloranyl-3-nitro-phenyl)-(6-oxidanyl-2-phenyl-chromen-4-ylidene)azanium perchlorate

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-(6-oxidanyl-2-phenyl-chromen-4-ylidene)azanium perchlorate Openeye Name: (4-chloro-3-nitro-phenyl)-(6-hydroxy-2-phenyl-chromen-4-ylidene)ammonium perchlorate CAS Name: (4-chloro-3-nitrophenyl)-(6-hydroxy-2-phenyl-1-benzopyran-4-ylidene)ammonium perchlorate IUPAC Name: (4-chloro-3-nitrophenyl)-(6-hydroxy-2-phenylchromen-4-ylidene)azanium perchlorate Traditional Name: (4-chloro-3-nitro-phenyl)-(6-hydroxy-2-phenyl-chromen-4-ylidene)ammonium perchlorate Formula: C21H14Cl2N2O8 MolecularWeight: 493.25046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[NH+]C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=C(O2)C=CC(=C4)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[NH+]C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=C(O2)C=CC(=C4)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H13ClN2O4.ClHO4/c22-17-8-6-14(10-19(17)24(26)27)23-18-12-21(13-4-2-1-3-5-13)28-20-9-7-15(25)11-16(18)20;2-1(3,4)5/h1-12,25H;(H,2,3,4,5)