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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1(C2=C(CCN1)C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CCC1(C2=C(CCN1)C=CC(=C2)[N+](=O)[O-])C

InChI

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