(4-nitrophenyl)methyl 3-azanylidene-3-ethoxy-propanoate hydrochloride

Systemtic Name: (4-nitrophenyl)methyl 3-azanylidene-3-ethoxy-propanoate hydrochloride Openeye Name: (4-nitrophenyl)methyl 3-ethoxy-3-imino-propanoate hydrochloride CAS Name: 3-ethoxy-3-iminopropanoic acid (4-nitrophenyl)methyl ester hydrochloride IUPAC Name: (4-nitrophenyl)methyl 3-ethoxy-3-iminopropanoate hydrochloride Traditional Name: 3-ethoxy-3-imino-propionic acid (4-nitrobenzyl) ester hydrochloride Formula: C12H15ClN2O5 MolecularWeight: 302.7109

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=N)CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-].Cl

Isomeric SMILES

CCOC(=N)CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-].Cl

InChI

InChI=1S/C12H14N2O5.ClH/c1-2-18-11(13)7-12(15)19-8-9-3-5-10(6-4-9)14(16)17;/h3-6,13H,2,7-8H2,1H3;1H