ethyl 3-[[4-(methylamino)-3-nitro-phenyl]carbonyl-(2-methylpropyl)amino]propanoate

Systemtic Name: ethyl 3-[[4-(methylamino)-3-nitro-phenyl]carbonyl-(2-methylpropyl)amino]propanoate Openeye Name: ethyl 3-[isobutyl-[4-(methylamino)-3-nitro-benzoyl]amino]propanoate CAS Name: 3-[[[4-(methylamino)-3-nitrophenyl]-oxomethyl]-(2-methylpropyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(methylamino)-3-nitrobenzoyl]-(2-methylpropyl)amino]propanoate Traditional Name: 3-[isobutyl-[4-(methylamino)-3-nitro-benzoyl]amino]propionic acid ethyl ester Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC(C)C)C(=O)C1=CC(=C(C=C1)NC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN(CC(C)C)C(=O)C1=CC(=C(C=C1)NC)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O5/c1-5-25-16(21)8-9-19(11-12(2)3)17(22)13-6-7-14(18-4)15(10-13)20(23)24/h6-7,10,12,18H,5,8-9,11H2,1-4H3