5-azanyl-5-(2-bromanyl-4,5-diethoxy-phenyl)pentanoic acid

Systemtic Name: 5-azanyl-5-(2-bromanyl-4,5-diethoxy-phenyl)pentanoic acid Openeye Name: 5-amino-5-(2-bromo-4,5-diethoxy-phenyl)pentanoic acid CAS Name: 5-amino-5-(2-bromo-4,5-diethoxyphenyl)pentanoic acid IUPAC Name: 5-amino-5-(2-bromo-4,5-diethoxyphenyl)pentanoic acid Traditional Name: 5-amino-5-(2-bromo-4,5-diethoxy-phenyl)valeric acid Formula: C15H22BrNO4 MolecularWeight: 360.24348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(CCCC(=O)O)N)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(CCCC(=O)O)N)Br)OCC

InChI

InChI=1S/C15H22BrNO4/c1-3-20-13-8-10(11(16)9-14(13)21-4-2)12(17)6-5-7-15(18)19/h8-9,12H,3-7,17H2,1-2H3,(H,18,19)