(phenylmethyl) 2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: benzyl 2-[(4-morpholino-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-morpholino-3-nitro-benzoyl)amino]acetic acid benzyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NCC(=O)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NCC(=O)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6/c24-19(29-14-15-4-2-1-3-5-15)13-21-20(25)16-6-7-17(18(12-16)23(26)27)22-8-10-28-11-9-22/h1-7,12H,8-11,13-14H2,(H,21,25)