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

Systemtic Name: (phenylmethyl) 2-[[4-(cyclopropylamino)-3-nitro-phenyl]carbonylamino]ethanoate Openeye Name: benzyl 2-[[4-(cyclopropylamino)-3-nitro-benzoyl]amino]acetate CAS Name: 2-[[[4-(cyclopropylamino)-3-nitrophenyl]-oxomethyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[4-(cyclopropylamino)-3-nitrobenzoyl]amino]acetate Traditional Name: 2-[[4-(cyclopropylamino)-3-nitro-benzoyl]amino]acetic acid benzyl ester Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NCC(=O)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NCC(=O)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c23-18(27-12-13-4-2-1-3-5-13)11-20-19(24)14-6-9-16(21-15-7-8-15)17(10-14)22(25)26/h1-6,9-10,15,21H,7-8,11-12H2,(H,20,24)