8-[2-(3,4-dichlorophenyl)ethyl]-3-nitro-10H-phenoxazine-1-carboxylic acid

Systemtic Name: 8-[2-(3,4-dichlorophenyl)ethyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Openeye Name: 8-[2-(3,4-dichlorophenyl)ethyl]-3-nitro-10H-phenoxazine-1-carboxylic acid CAS Name: 8-[2-(3,4-dichlorophenyl)ethyl]-3-nitro-10H-phenoxazine-1-carboxylic acid IUPAC Name: 8-[2-(3,4-dichlorophenyl)ethyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Traditional Name: 8-[2-(3,4-dichlorophenyl)ethyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Formula: C21H14Cl2N2O5 MolecularWeight: 445.25226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCC3=CC(=C(C=C3)Cl)Cl)NC4=C(O2)C=C(C=C4C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1CCC3=CC(=C(C=C3)Cl)Cl)NC4=C(O2)C=C(C=C4C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C21H14Cl2N2O5/c22-15-5-3-11(7-16(15)23)1-2-12-4-6-18-17(8-12)24-20-14(21(26)27)9-13(25(28)29)10-19(20)30-18/h3-10,24H,1-2H2,(H,26,27)