3-(3,4-dichlorophenyl)propyl hydrogen carbonate; 3-nitro-10H-phenoxazine

Systemtic Name: 3-(3,4-dichlorophenyl)propyl hydrogen carbonate; 3-nitro-10H-phenoxazine Openeye Name: 3-(3,4-dichlorophenyl)propyl hydrogen carbonate; 3-nitro-10H-phenoxazine CAS Name: carbonic acid 3-(3,4-dichlorophenyl)propyl ester; 3-nitro-10H-phenoxazine IUPAC Name: 3-(3,4-dichlorophenyl)propyl hydrogen carbonate; 3-nitro-10H-phenoxazine Traditional Name: carbonic acid 3-(3,4-dichlorophenyl)propyl ester; 3-nitro-10H-phenoxazine Formula: C22H18Cl2N2O6 MolecularWeight: 477.29412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC3=C(O2)C=C(C=C3)[N+](=O)[O-].C1=CC(=C(C=C1CCCOC(=O)O)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC3=C(O2)C=C(C=C3)[N+](=O)[O-].C1=CC(=C(C=C1CCCOC(=O)O)Cl)Cl

InChI

InChI=1S/C12H8N2O3.C10H10Cl2O3/c15-14(16)8-5-6-10-12(7-8)17-11-4-2-1-3-9(11)13-10;11-8-4-3-7(6-9(8)12)2-1-5-15-10(13)14/h1-7,13H;3-4,6H,1-2,5H2,(H,13,14)