4-[2-[[4-(dipentylamino)-2-methyl-phenyl]carbonylamino]phenoxy]butanoic acid

Systemtic Name: 4-[2-[[4-(dipentylamino)-2-methyl-phenyl]carbonylamino]phenoxy]butanoic acid Openeye Name: 4-[2-[[4-(dipentylamino)-2-methyl-benzoyl]amino]phenoxy]butanoic acid CAS Name: 4-[2-[[[4-(dipentylamino)-2-methylphenyl]-oxomethyl]amino]phenoxy]butanoic acid IUPAC Name: 4-[2-[[4-(dipentylamino)-2-methylbenzoyl]amino]phenoxy]butanoic acid Traditional Name: 4-[2-[[4-(diamylamino)-2-methyl-benzoyl]amino]phenoxy]butyric acid Formula: C28H40N2O4 MolecularWeight: 468.6282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C1=CC(=C(C=C1)C(=O)NC2=CC=CC=C2OCCCC(=O)O)C

Isomeric SMILES

CCCCCN(CCCCC)C1=CC(=C(C=C1)C(=O)NC2=CC=CC=C2OCCCC(=O)O)C

InChI

InChI=1S/C28H40N2O4/c1-4-6-10-18-30(19-11-7-5-2)23-16-17-24(22(3)21-23)28(33)29-25-13-8-9-14-26(25)34-20-12-15-27(31)32/h8-9,13-14,16-17,21H,4-7,10-12,15,18-20H2,1-3H3,(H,29,33)(H,31,32)