(3-nitrophenyl)methyl 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate

Systemtic Name: (3-nitrophenyl)methyl 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate Openeye Name: (3-nitrophenyl)methyl 3-(3-oxo-4H-quinoxalin-2-yl)propanoate CAS Name: 3-(3-oxo-4H-quinoxalin-2-yl)propanoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3-(3-oxo-4H-quinoxalin-2-yl)propanoate Traditional Name: 3-(3-keto-4H-quinoxalin-2-yl)propionic acid (3-nitrobenzyl) ester Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)CCC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)CCC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O5/c22-17(26-11-12-4-3-5-13(10-12)21(24)25)9-8-16-18(23)20-15-7-2-1-6-14(15)19-16/h1-7,10H,8-9,11H2,(H,20,23)