methyl 3-[3-bromanyl-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitro-phenyl]propanoate

Systemtic Name: methyl 3-[3-bromanyl-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitro-phenyl]propanoate Openeye Name: methyl 3-(3-bromo-4-indan-2-yloxy-5-nitro-phenyl)propanoate CAS Name: 3-[3-bromo-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitrophenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-bromo-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitrophenyl]propanoate Traditional Name: 3-(3-bromo-4-indan-2-yloxy-5-nitro-phenyl)propionic acid methyl ester Formula: C19H18BrNO5 MolecularWeight: 420.25392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC(=C(C(=C1)Br)OC2CC3=CC=CC=C3C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCC1=CC(=C(C(=C1)Br)OC2CC3=CC=CC=C3C2)[N+](=O)[O-]

InChI

InChI=1S/C19H18BrNO5/c1-25-18(22)7-6-12-8-16(20)19(17(9-12)21(23)24)26-15-10-13-4-2-3-5-14(13)11-15/h2-5,8-9,15H,6-7,10-11H2,1H3