2-nitroethyl 3-azanyl-3-phenylimino-propanoate

Systemtic Name: 2-nitroethyl 3-azanyl-3-phenylimino-propanoate Openeye Name: 2-nitroethyl 3-amino-3-phenylimino-propanoate CAS Name: 3-amino-3-phenyliminopropanoic acid 2-nitroethyl ester IUPAC Name: 2-nitroethyl 3-amino-3-phenyliminopropanoate Traditional Name: 3-amino-3-phenylimino-propionic acid 2-nitroethyl ester Formula: C11H13N3O4 MolecularWeight: 251.23862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(CC(=O)OCC[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)N=C(CC(=O)OCC[N+](=O)[O-])N

InChI

InChI=1S/C11H13N3O4/c12-10(13-9-4-2-1-3-5-9)8-11(15)18-7-6-14(16)17/h1-5H,6-8H2,(H2,12,13)