6-[[3-(6-methyl-1,3-benzoxazol-2-yl)-4-(propylamino)phenyl]carbamoylamino]hexanoic acid

Systemtic Name: 6-[[3-(6-methyl-1,3-benzoxazol-2-yl)-4-(propylamino)phenyl]carbamoylamino]hexanoic acid Openeye Name: 6-[[3-(6-methyl-1,3-benzoxazol-2-yl)-4-(propylamino)phenyl]carbamoylamino]hexanoic acid CAS Name: 6-[[[3-(6-methyl-1,3-benzoxazol-2-yl)-4-(propylamino)anilino]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[[3-(6-methyl-1,3-benzoxazol-2-yl)-4-(propylamino)phenyl]carbamoylamino]hexanoic acid Traditional Name: 6-[[3-(6-methyl-1,3-benzoxazol-2-yl)-4-(propylamino)phenyl]carbamoylamino]hexanoic acid Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)NC(=O)NCCCCCC(=O)O)C2=NC3=C(O2)C=C(C=C3)C

Isomeric SMILES

CCCNC1=C(C=C(C=C1)NC(=O)NCCCCCC(=O)O)C2=NC3=C(O2)C=C(C=C3)C

InChI

InChI=1S/C24H30N4O4/c1-3-12-25-19-11-9-17(27-24(31)26-13-6-4-5-7-22(29)30)15-18(19)23-28-20-10-8-16(2)14-21(20)32-23/h8-11,14-15,25H,3-7,12-13H2,1-2H3,(H,29,30)(H2,26,27,31)