6-[2-[[4-[(2-aminophenyl)carbonylamino]phenyl]carbonyl-methyl-amino]-5-methyl-phenoxy]hexanoic acid

Systemtic Name: 6-[2-[[4-[(2-aminophenyl)carbonylamino]phenyl]carbonyl-methyl-amino]-5-methyl-phenoxy]hexanoic acid Openeye Name: 6-[2-[[4-[(2-aminobenzoyl)amino]benzoyl]-methyl-amino]-5-methyl-phenoxy]hexanoic acid CAS Name: 6-[2-[[[4-[[(2-aminophenyl)-oxomethyl]amino]phenyl]-oxomethyl]-methylamino]-5-methylphenoxy]hexanoic acid IUPAC Name: 6-[2-[[4-[(2-aminobenzoyl)amino]benzoyl]-methylamino]-5-methylphenoxy]hexanoic acid Traditional Name: 6-[2-[[4-(anthraniloylamino)benzoyl]-methyl-amino]-5-methyl-phenoxy]hexanoic acid Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3N)OCCCCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3N)OCCCCCC(=O)O

InChI

InChI=1S/C28H31N3O5/c1-19-11-16-24(25(18-19)36-17-7-3-4-10-26(32)33)31(2)28(35)20-12-14-21(15-13-20)30-27(34)22-8-5-6-9-23(22)29/h5-6,8-9,11-16,18H,3-4,7,10,17,29H2,1-2H3,(H,30,34)(H,32,33)