2-[[6-(furan-2-ylcarbonylamino)-5-methyl-4-oxidanylidene-1,3-benzoxazin-2-yl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[6-(furan-2-ylcarbonylamino)-5-methyl-4-oxidanylidene-1,3-benzoxazin-2-yl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[6-(furan-2-carbonylamino)-5-methyl-4-oxo-1,3-benzoxazin-2-yl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[6-[[2-furanyl(oxo)methyl]amino]-5-methyl-4-oxo-1,3-benzoxazin-2-yl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[6-(furan-2-carbonylamino)-5-methyl-4-oxo-1,3-benzoxazin-2-yl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[6-(2-furoylamino)-4-keto-5-methyl-1,3-benzoxazin-2-yl]amino]-3-phenyl-propionic acid Formula: C23H19N3O6 MolecularWeight: 433.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)N=C(O2)NC(CC3=CC=CC=C3)C(=O)O)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)N=C(O2)NC(CC3=CC=CC=C3)C(=O)O)NC(=O)C4=CC=CO4

InChI

InChI=1S/C23H19N3O6/c1-13-15(24-20(27)18-8-5-11-31-18)9-10-17-19(13)21(28)26-23(32-17)25-16(22(29)30)12-14-6-3-2-4-7-14/h2-11,16H,12H2,1H3,(H,24,27)(H,29,30)(H,25,26,28)