2-[[3-(2-ethylbutanoylamino)-4-methyl-phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[3-(2-ethylbutanoylamino)-4-methyl-phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[3-(2-ethylbutanoylamino)-4-methyl-benzoyl]amino]benzoic acid CAS Name: 2-[[[3-[(2-ethyl-1-oxobutyl)amino]-4-methylphenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[3-(2-ethylbutanoylamino)-4-methylbenzoyl]amino]benzoic acid Traditional Name: 2-[[3-(2-ethylbutanoylamino)-4-methyl-benzoyl]amino]benzoic acid Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C21H24N2O4/c1-4-14(5-2)19(24)23-18-12-15(11-10-13(18)3)20(25)22-17-9-7-6-8-16(17)21(26)27/h6-12,14H,4-5H2,1-3H3,(H,22,25)(H,23,24)(H,26,27)