2-[2-(5-bromanyl-6-methoxy-naphthalen-2-yl)propanoylamino]pentanedioic acid

Systemtic Name: 2-[2-(5-bromanyl-6-methoxy-naphthalen-2-yl)propanoylamino]pentanedioic acid Openeye Name: 2-[2-(5-bromo-6-methoxy-2-naphthyl)propanoylamino]pentanedioic acid CAS Name: 2-[[2-(5-bromo-6-methoxy-2-naphthalenyl)-1-oxopropyl]amino]pentanedioic acid IUPAC Name: 2-[2-(5-bromo-6-methoxynaphthalen-2-yl)propanoylamino]pentanedioic acid Traditional Name: 2-[2-(5-bromo-6-methoxy-2-naphthyl)propanoylamino]glutaric acid Formula: C19H20BrNO6 MolecularWeight: 438.2692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C(=C(C=C2)OC)Br)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)C(=C(C=C2)OC)Br)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C19H20BrNO6/c1-10(18(24)21-14(19(25)26)6-8-16(22)23)11-3-5-13-12(9-11)4-7-15(27-2)17(13)20/h3-5,7,9-10,14H,6,8H2,1-2H3,(H,21,24)(H,22,23)(H,25,26)