4-[[(4-butylphenyl)methyl-heptyl-carbamoyl]amino]benzoic acid

Systemtic Name: 4-[[(4-butylphenyl)methyl-heptyl-carbamoyl]amino]benzoic acid Openeye Name: 4-[[(4-butylphenyl)methyl-heptyl-carbamoyl]amino]benzoic acid CAS Name: 4-[[[(4-butylphenyl)methyl-heptylamino]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[(4-butylphenyl)methyl-heptylcarbamoyl]amino]benzoic acid Traditional Name: 4-[[(4-butylbenzyl)-heptyl-carbamoyl]amino]benzoic acid Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)CCCC)C(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)CCCC)C(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C26H36N2O3/c1-3-5-7-8-9-19-28(20-22-13-11-21(12-14-22)10-6-4-2)26(31)27-24-17-15-23(16-18-24)25(29)30/h11-18H,3-10,19-20H2,1-2H3,(H,27,31)(H,29,30)