ethyl 3-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butanoate

Systemtic Name: ethyl 3-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butanoate Openeye Name: ethyl 3-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butanoate CAS Name: 3-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butanoic acid ethyl ester IUPAC Name: ethyl 3-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butanoate Traditional Name: 3-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butyric acid ethyl ester Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)N1CCC2=C(C1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC(C)N1CCC2=C(C1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O4/c1-3-21-15(18)8-11(2)16-7-6-12-4-5-14(17(19)20)9-13(12)10-16/h4-5,9,11H,3,6-8,10H2,1-2H3