4-[2-(3-bromanyl-4-butoxy-5-methoxy-phenyl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(3-bromanyl-4-butoxy-5-methoxy-phenyl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(3-bromo-4-butoxy-5-methoxy-phenyl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(3-bromo-4-butoxy-5-methoxyphenyl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-(3-bromo-4-butoxy-5-methoxyphenyl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-(3-bromo-4-butoxy-5-methoxy-phenyl)ethylamino]-4-keto-butyric acid Formula: C17H24BrNO5 MolecularWeight: 402.28016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Br)CCNC(=O)CCC(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Br)CCNC(=O)CCC(=O)O)OC

InChI

InChI=1S/C17H24BrNO5/c1-3-4-9-24-17-13(18)10-12(11-14(17)23-2)7-8-19-15(20)5-6-16(21)22/h10-11H,3-9H2,1-2H3,(H,19,20)(H,21,22)