3,5-bis[8-methoxycarbonyloxy-2,4-bis(oxidanylidene)-1,3-benzoxazin-3-yl]benzoic acid

Systemtic Name: 3,5-bis[8-methoxycarbonyloxy-2,4-bis(oxidanylidene)-1,3-benzoxazin-3-yl]benzoic acid Openeye Name: 3,5-bis(8-methoxycarbonyloxy-2,4-dioxo-1,3-benzoxazin-3-yl)benzoic acid CAS Name: 3,5-bis(8-methoxycarbonyloxy-2,4-dioxo-1,3-benzoxazin-3-yl)benzoic acid IUPAC Name: 3,5-bis(8-methoxycarbonyloxy-2,4-dioxo-1,3-benzoxazin-3-yl)benzoic acid Traditional Name: 3,5-bis(8-carbomethoxyoxy-2,4-diketo-1,3-benzoxazin-3-yl)benzoic acid Formula: C27H16N2O14 MolecularWeight: 592.42094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1=CC=CC2=C1OC(=O)N(C2=O)C3=CC(=CC(=C3)C(=O)O)N4C(=O)C5=C(C(=CC=C5)OC(=O)OC)OC4=O

Isomeric SMILES

COC(=O)OC1=CC=CC2=C1OC(=O)N(C2=O)C3=CC(=CC(=C3)C(=O)O)N4C(=O)C5=C(C(=CC=C5)OC(=O)OC)OC4=O

InChI

InChI=1S/C27H16N2O14/c1-38-26(36)40-17-7-3-5-15-19(17)42-24(34)28(21(15)30)13-9-12(23(32)33)10-14(11-13)29-22(31)16-6-4-8-18(41-27(37)39-2)20(16)43-25(29)35/h3-11H,1-2H3,(H,32,33)