methyl 2-[(2-nitro-5-piperazin-1-yl-phenyl)carbonylamino]propanoate

Systemtic Name: methyl 2-[(2-nitro-5-piperazin-1-yl-phenyl)carbonylamino]propanoate Openeye Name: methyl 2-[(2-nitro-5-piperazin-1-yl-benzoyl)amino]propanoate CAS Name: 2-[[[2-nitro-5-(1-piperazinyl)phenyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[(2-nitro-5-piperazin-1-ylbenzoyl)amino]propanoate Traditional Name: 2-[(2-nitro-5-piperazino-benzoyl)amino]propionic acid methyl ester Formula: C15H20N4O5 MolecularWeight: 336.3431

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1=C(C=CC(=C1)N2CCNCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC)NC(=O)C1=C(C=CC(=C1)N2CCNCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N4O5/c1-10(15(21)24-2)17-14(20)12-9-11(3-4-13(12)19(22)23)18-7-5-16-6-8-18/h3-4,9-10,16H,5-8H2,1-2H3,(H,17,20)