ethyl 4-(dimethylamino)-2-(3-nitrophenyl)butanoate

Systemtic Name: ethyl 4-(dimethylamino)-2-(3-nitrophenyl)butanoate Openeye Name: ethyl 4-(dimethylamino)-2-(3-nitrophenyl)butanoate CAS Name: 4-(dimethylamino)-2-(3-nitrophenyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(dimethylamino)-2-(3-nitrophenyl)butanoate Traditional Name: 4-(dimethylamino)-2-(3-nitrophenyl)butyric acid ethyl ester Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4/c1-4-20-14(17)13(8-9-15(2)3)11-6-5-7-12(10-11)16(18)19/h5-7,10,13H,4,8-9H2,1-3H3