methyl 4-methyl-2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]pentanoate Openeye Name: methyl 4-methyl-2-[(4-morpholino-3-nitro-benzoyl)amino]pentanoate CAS Name: 4-methyl-2-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]pentanoate Traditional Name: 4-methyl-2-[(4-morpholino-3-nitro-benzoyl)amino]valeric acid methyl ester Formula: C18H25N3O6 MolecularWeight: 379.4076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O6/c1-12(2)10-14(18(23)26-3)19-17(22)13-4-5-15(16(11-13)21(24)25)20-6-8-27-9-7-20/h4-5,11-12,14H,6-10H2,1-3H3,(H,19,22)