ethyl 3-(4-methyl-7-nitro-1,2,3,4-tetrahydroisoquinolin-1-yl)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1C2=C(C=CC(=C2)[N+](=O)[O-])C(CN1)C

Isomeric SMILES

CCOC(=O)CCC1C2=C(C=CC(=C2)[N+](=O)[O-])C(CN1)C

InChI

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