4-[[2-bromanyl-1,4-bis(oxidanylidene)-3,8a-dihydro-2H-naphthalen-4a-yl]amino]butanoic acid

Systemtic Name: 4-[[2-bromanyl-1,4-bis(oxidanylidene)-3,8a-dihydro-2H-naphthalen-4a-yl]amino]butanoic acid Openeye Name: 4-[(2-bromo-1,4-dioxo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]butanoic acid CAS Name: 4-[(2-bromo-1,4-dioxo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]butanoic acid IUPAC Name: 4-[(2-bromo-1,4-dioxo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]butanoic acid Traditional Name: 4-[(2-bromo-1,4-diketo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]butyric acid Formula: C14H16BrNO4 MolecularWeight: 342.18514

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2C=CC=CC2(C1=O)NCCCC(=O)O)Br

Isomeric SMILES

C1C(C(=O)C2C=CC=CC2(C1=O)NCCCC(=O)O)Br

InChI

InChI=1S/C14H16BrNO4/c15-10-8-11(17)14(16-7-3-5-12(18)19)6-2-1-4-9(14)13(10)20/h1-2,4,6,9-10,16H,3,5,7-8H2,(H,18,19)