2-[[2-(2-octan-3-yloxycarbonylphenoxy)ethanoylamino]carbamoyl]benzoic acid

Systemtic Name: 2-[[2-(2-octan-3-yloxycarbonylphenoxy)ethanoylamino]carbamoyl]benzoic acid Openeye Name: 2-[[[2-[2-(1-ethylhexoxycarbonyl)phenoxy]acetyl]amino]carbamoyl]benzoic acid CAS Name: 2-[[[2-[2-[octan-3-yloxy(oxo)methyl]phenoxy]-1-oxoethyl]hydrazo]-oxomethyl]benzoic acid IUPAC Name: 2-[[[2-(2-octan-3-yloxycarbonylphenoxy)acetyl]amino]carbamoyl]benzoic acid Traditional Name: 2-[[[2-[2-(1-ethylhexoxycarbonyl)phenoxy]acetyl]amino]carbamoyl]benzoic acid Formula: C25H30N2O7 MolecularWeight: 470.5149

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CC=CC=C1OCC(=O)NNC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CC=CC=C1OCC(=O)NNC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C25H30N2O7/c1-3-5-6-11-17(4-2)34-25(32)20-14-9-10-15-21(20)33-16-22(28)26-27-23(29)18-12-7-8-13-19(18)24(30)31/h7-10,12-15,17H,3-6,11,16H2,1-2H3,(H,26,28)(H,27,29)(H,30,31)