6-[[4-methoxy-3-[5-(4-methylphenyl)-1,3-benzoxazol-2-yl]phenyl]carbamoylamino]hexanoic acid

Systemtic Name: 6-[[4-methoxy-3-[5-(4-methylphenyl)-1,3-benzoxazol-2-yl]phenyl]carbamoylamino]hexanoic acid Openeye Name: 6-[[4-methoxy-3-[5-(p-tolyl)-1,3-benzoxazol-2-yl]phenyl]carbamoylamino]hexanoic acid CAS Name: 6-[[[4-methoxy-3-[5-(4-methylphenyl)-1,3-benzoxazol-2-yl]anilino]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[[4-methoxy-3-[5-(4-methylphenyl)-1,3-benzoxazol-2-yl]phenyl]carbamoylamino]hexanoic acid Traditional Name: 6-[[4-methoxy-3-[5-(p-tolyl)-1,3-benzoxazol-2-yl]phenyl]carbamoylamino]hexanoic acid Formula: C28H29N3O5 MolecularWeight: 487.54696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)NC(=O)NCCCCCC(=O)O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)NC(=O)NCCCCCC(=O)O)OC

InChI

InChI=1S/C28H29N3O5/c1-18-7-9-19(10-8-18)20-11-13-25-23(16-20)31-27(36-25)22-17-21(12-14-24(22)35-2)30-28(34)29-15-5-3-4-6-26(32)33/h7-14,16-17H,3-6,15H2,1-2H3,(H,32,33)(H2,29,30,34)