2-methylpentyl 3-[4-azanyl-3,5-bis(bromanyl)phenyl]propanoate

Systemtic Name: 2-methylpentyl 3-[4-azanyl-3,5-bis(bromanyl)phenyl]propanoate Openeye Name: 2-methylpentyl 3-(4-amino-3,5-dibromo-phenyl)propanoate CAS Name: 3-(4-amino-3,5-dibromophenyl)propanoic acid 2-methylpentyl ester IUPAC Name: 2-methylpentyl 3-(4-amino-3,5-dibromophenyl)propanoate Traditional Name: 3-(4-amino-3,5-dibromo-phenyl)propionic acid 2-methylpentyl ester Formula: C15H21Br2NO2 MolecularWeight: 407.14074

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)COC(=O)CCC1=CC(=C(C(=C1)Br)N)Br

Isomeric SMILES

CCCC(C)COC(=O)CCC1=CC(=C(C(=C1)Br)N)Br

InChI

InChI=1S/C15H21Br2NO2/c1-3-4-10(2)9-20-14(19)6-5-11-7-12(16)15(18)13(17)8-11/h7-8,10H,3-6,9,18H2,1-2H3