2-[[(2-butyl-2-oxidanyl-hexanoyl)amino]-phenyl-carbamoyl]benzoic acid

Systemtic Name: 2-[[(2-butyl-2-oxidanyl-hexanoyl)amino]-phenyl-carbamoyl]benzoic acid Openeye Name: 2-[[(2-butyl-2-hydroxy-hexanoyl)amino]-phenyl-carbamoyl]benzoic acid CAS Name: 2-[(N-[(2-butyl-2-hydroxy-1-oxohexyl)amino]anilino)-oxomethyl]benzoic acid IUPAC Name: 2-[[(2-butyl-2-hydroxyhexanoyl)amino]-phenylcarbamoyl]benzoic acid Traditional Name: 2-[[(2-butyl-2-hydroxy-hexanoyl)amino]-phenyl-carbamoyl]benzoic acid Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(C(=O)NN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2C(=O)O)O

Isomeric SMILES

CCCCC(CCCC)(C(=O)NN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2C(=O)O)O

InChI

InChI=1S/C24H30N2O5/c1-3-5-16-24(31,17-6-4-2)23(30)25-26(18-12-8-7-9-13-18)21(27)19-14-10-11-15-20(19)22(28)29/h7-15,31H,3-6,16-17H2,1-2H3,(H,25,30)(H,28,29)