2-chloroethyl 2,5-bis(azanyl)-3-chloranyl-6-nitro-benzoate

Systemtic Name: 2-chloroethyl 2,5-bis(azanyl)-3-chloranyl-6-nitro-benzoate Openeye Name: 2-chloroethyl 2,5-diamino-3-chloro-6-nitro-benzoate CAS Name: 2,5-diamino-3-chloro-6-nitrobenzoic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 2,5-diamino-3-chloro-6-nitrobenzoate Traditional Name: 2,5-diamino-3-chloro-6-nitro-benzoic acid 2-chloroethyl ester Formula: C9H9Cl2N3O4 MolecularWeight: 294.09146

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1Cl)N)C(=O)OCCCl)[N+](=O)[O-])N

Isomeric SMILES

C1=C(C(=C(C(=C1Cl)N)C(=O)OCCCl)[N+](=O)[O-])N

InChI

InChI=1S/C9H9Cl2N3O4/c10-1-2-18-9(15)6-7(13)4(11)3-5(12)8(6)14(16)17/h3H,1-2,12-13H2