ethyl 3-azanyl-3-(2-chloranyl-4-nitro-phenyl)imino-propanoate hydrochloride

Systemtic Name: ethyl 3-azanyl-3-(2-chloranyl-4-nitro-phenyl)imino-propanoate hydrochloride Openeye Name: ethyl 3-amino-3-(2-chloro-4-nitro-phenyl)imino-propanoate hydrochloride CAS Name: 3-amino-3-(2-chloro-4-nitrophenyl)iminopropanoic acid ethyl ester hydrochloride IUPAC Name: ethyl 3-amino-3-(2-chloro-4-nitrophenyl)iminopropanoate hydrochloride Traditional Name: 3-amino-3-(2-chloro-4-nitro-phenyl)imino-propionic acid ethyl ester hydrochloride Formula: C11H13Cl2N3O4 MolecularWeight: 322.14462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N.Cl

Isomeric SMILES

CCOC(=O)CC(=NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N.Cl

InChI

InChI=1S/C11H12ClN3O4.ClH/c1-2-19-11(16)6-10(13)14-9-4-3-7(15(17)18)5-8(9)12;/h3-5H,2,6H2,1H3,(H2,13,14);1H