methyl 5-bromanyl-2-[(1-nitro-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]pentanoate

Systemtic Name: methyl 5-bromanyl-2-[(1-nitro-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]pentanoate Openeye Name: methyl 5-bromo-2-(5-nitrotetralin-6-yl)oxy-pentanoate CAS Name: 5-bromo-2-[(1-nitro-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]pentanoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(1-nitro-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]pentanoate Traditional Name: 5-bromo-2-(5-nitrotetralin-6-yl)oxy-valeric acid methyl ester Formula: C16H20BrNO5 MolecularWeight: 386.2377

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCBr)OC1=C(C2=C(CCCC2)C=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CCCBr)OC1=C(C2=C(CCCC2)C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H20BrNO5/c1-22-16(19)14(7-4-10-17)23-13-9-8-11-5-2-3-6-12(11)15(13)18(20)21/h8-9,14H,2-7,10H2,1H3