4-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methylamino]-4-oxo-butanoate CAS Name: 4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylamino]-4-oxobutanoate IUPAC Name: 4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylamino]-4-oxobutanoate Traditional Name: 4-[(3-bromo-4-ethoxy-5-methoxy-benzyl)amino]-4-keto-butyrate Formula: C14H17BrNO5- MolecularWeight: 359.19248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)CNC(=O)CCC(=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)CNC(=O)CCC(=O)[O-])OC

InChI

InChI=1S/C14H18BrNO5/c1-3-21-14-10(15)6-9(7-11(14)20-2)8-16-12(17)4-5-13(18)19/h6-7H,3-5,8H2,1-2H3,(H,16,17)(H,18,19)/p-1