2-[3-(5-bromanyl-6-methoxy-naphthalen-2-yl)propanoyl]-2-oxidanyl-butanedioic acid

Systemtic Name: 2-[3-(5-bromanyl-6-methoxy-naphthalen-2-yl)propanoyl]-2-oxidanyl-butanedioic acid Openeye Name: 2-[3-(5-bromo-6-methoxy-2-naphthyl)propanoyl]-2-hydroxy-butanedioic acid CAS Name: 2-[3-(5-bromo-6-methoxy-2-naphthalenyl)-1-oxopropyl]-2-hydroxybutanedioic acid IUPAC Name: 2-[3-(5-bromo-6-methoxynaphthalen-2-yl)propanoyl]-2-hydroxybutanedioic acid Traditional Name: 2-[3-(5-bromo-6-methoxy-2-naphthyl)propanoyl]-2-hydroxy-succinic acid Formula: C18H17BrO7 MolecularWeight: 425.22738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C=C(C=C2)CCC(=O)C(CC(=O)O)(C(=O)O)O)Br

Isomeric SMILES

COC1=C(C2=C(C=C1)C=C(C=C2)CCC(=O)C(CC(=O)O)(C(=O)O)O)Br

InChI

InChI=1S/C18H17BrO7/c1-26-13-6-4-11-8-10(2-5-12(11)16(13)19)3-7-14(20)18(25,17(23)24)9-15(21)22/h2,4-6,8,25H,3,7,9H2,1H3,(H,21,22)(H,23,24)