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

Systemtic Name: ethyl 2-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)ethanoate Openeye Name: ethyl 2-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)acetate CAS Name: 2-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)acetate Traditional Name: 2-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)acetic acid ethyl ester Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCC2=C(C1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CN1CCC2=C(C1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O4/c1-2-19-13(16)9-14-6-5-10-3-4-12(15(17)18)7-11(10)8-14/h3-4,7H,2,5-6,8-9H2,1H3