2-[(3-chlorophenyl)carbamoylamino]-5-octyl-benzoic acid

Systemtic Name: 2-[(3-chlorophenyl)carbamoylamino]-5-octyl-benzoic acid Openeye Name: 2-[(3-chlorophenyl)carbamoylamino]-5-octyl-benzoic acid CAS Name: 2-[[(3-chloroanilino)-oxomethyl]amino]-5-octylbenzoic acid IUPAC Name: 2-[(3-chlorophenyl)carbamoylamino]-5-octylbenzoic acid Traditional Name: 2-[(3-chlorophenyl)carbamoylamino]-5-octyl-benzoic acid Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)NC(=O)NC2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)NC(=O)NC2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C22H27ClN2O3/c1-2-3-4-5-6-7-9-16-12-13-20(19(14-16)21(26)27)25-22(28)24-18-11-8-10-17(23)15-18/h8,10-15H,2-7,9H2,1H3,(H,26,27)(H2,24,25,28)