2-(2-chloroethylamino)ethyl 3-nitrobenzoate hydrochloride

Systemtic Name: 2-(2-chloroethylamino)ethyl 3-nitrobenzoate hydrochloride Openeye Name: 2-(2-chloroethylamino)ethyl 3-nitrobenzoate hydrochloride CAS Name: 3-nitrobenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride IUPAC Name: 2-(2-chloroethylamino)ethyl 3-nitrobenzoate hydrochloride Traditional Name: 3-nitrobenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride Formula: C11H14Cl2N2O4 MolecularWeight: 309.14586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCNCCCl.Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCNCCCl.Cl

InChI

InChI=1S/C11H13ClN2O4.ClH/c12-4-5-13-6-7-18-11(15)9-2-1-3-10(8-9)14(16)17;/h1-3,8,13H,4-7H2;1H