3-[4-[2-[2-[(2-methoxyphenyl)amino]-1,3-benzoxazol-6-yl]ethanoylamino]phenyl]-3-[(5-methyl-1,2-oxazol-3-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[4-[2-[2-[(2-methoxyphenyl)amino]-1,3-benzoxazol-6-yl]ethanoylamino]phenyl]-3-[(5-methyl-1,2-oxazol-3-yl)carbonylamino]propanoic acid Openeye Name: 3-[4-[[2-[2-(2-methoxyanilino)-1,3-benzoxazol-6-yl]acetyl]amino]phenyl]-3-[(5-methylisoxazole-3-carbonyl)amino]propanoic acid CAS Name: 3-[4-[[2-[2-(2-methoxyanilino)-1,3-benzoxazol-6-yl]-1-oxoethyl]amino]phenyl]-3-[[(5-methyl-3-isoxazolyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-[[2-[2-(2-methoxyanilino)-1,3-benzoxazol-6-yl]acetyl]amino]phenyl]-3-[(5-methyl-1,2-oxazole-3-carbonyl)amino]propanoic acid Traditional Name: 3-[(5-methylisoxazole-3-carbonyl)amino]-3-[4-[[2-[2-(o-anisidino)-1,3-benzoxazol-6-yl]acetyl]amino]phenyl]propionic acid Formula: C30H27N5O7 MolecularWeight: 569.56468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NC(CC(=O)O)C2=CC=C(C=C2)NC(=O)CC3=CC4=C(C=C3)N=C(O4)NC5=CC=CC=C5OC

Isomeric SMILES

CC1=CC(=NO1)C(=O)NC(CC(=O)O)C2=CC=C(C=C2)NC(=O)CC3=CC4=C(C=C3)N=C(O4)NC5=CC=CC=C5OC

InChI

InChI=1S/C30H27N5O7/c1-17-13-24(35-42-17)29(39)32-23(16-28(37)38)19-8-10-20(11-9-19)31-27(36)15-18-7-12-22-26(14-18)41-30(34-22)33-21-5-3-4-6-25(21)40-2/h3-14,23H,15-16H2,1-2H3,(H,31,36)(H,32,39)(H,33,34)(H,37,38)