3-(3-bromanyl-1-ethoxycarbonyl-2H-quinolin-2-yl)propanoic acid

Systemtic Name: 3-(3-bromanyl-1-ethoxycarbonyl-2H-quinolin-2-yl)propanoic acid Openeye Name: 3-(3-bromo-1-ethoxycarbonyl-2H-quinolin-2-yl)propanoic acid CAS Name: 3-(3-bromo-1-ethoxycarbonyl-2H-quinolin-2-yl)propanoic acid IUPAC Name: 3-(3-bromo-1-ethoxycarbonyl-2H-quinolin-2-yl)propanoic acid Traditional Name: 3-(3-bromo-1-carbethoxy-2H-quinolin-2-yl)propionic acid Formula: C15H16BrNO4 MolecularWeight: 354.19584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=CC2=CC=CC=C21)Br)CCC(=O)O

Isomeric SMILES

CCOC(=O)N1C(C(=CC2=CC=CC=C21)Br)CCC(=O)O

InChI

InChI=1S/C15H16BrNO4/c1-2-21-15(20)17-12-6-4-3-5-10(12)9-11(16)13(17)7-8-14(18)19/h3-6,9,13H,2,7-8H2,1H3,(H,18,19)