4-[(6-bromanyl-2H-chromen-3-yl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(6-bromanyl-2H-chromen-3-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(6-bromo-2H-chromene-3-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(6-bromo-2H-1-benzopyran-3-yl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(6-bromo-2H-chromene-3-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(6-bromo-2H-chromene-3-carbonyl)-methyl-amino]butyric acid Formula: C15H16BrNO4 MolecularWeight: 354.19584

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C1=CC2=C(C=CC(=C2)Br)OC1

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C1=CC2=C(C=CC(=C2)Br)OC1

InChI

InChI=1S/C15H16BrNO4/c1-17(6-2-3-14(18)19)15(20)11-7-10-8-12(16)4-5-13(10)21-9-11/h4-5,7-8H,2-3,6,9H2,1H3,(H,18,19)