6-methyl-2-[(E)-2-(6-methyl-1,3-benzoxazol-2-yl)ethenyl]-1,3-benzoxazole-4-sulfonic acid

Systemtic Name: 6-methyl-2-[(E)-2-(6-methyl-1,3-benzoxazol-2-yl)ethenyl]-1,3-benzoxazole-4-sulfonic acid Openeye Name: 6-methyl-2-[(E)-2-(6-methyl-1,3-benzoxazol-2-yl)vinyl]-1,3-benzoxazole-4-sulfonic acid CAS Name: 6-methyl-2-[(E)-2-(6-methyl-1,3-benzoxazol-2-yl)ethenyl]-1,3-benzoxazole-4-sulfonic acid IUPAC Name: 6-methyl-2-[(E)-2-(6-methyl-1,3-benzoxazol-2-yl)ethenyl]-1,3-benzoxazole-4-sulfonic acid Traditional Name: 6-methyl-2-[(E)-2-(6-methyl-1,3-benzoxazol-2-yl)vinyl]-1,3-benzoxazole-4-sulfonic acid Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C=CC3=NC4=C(O3)C=C(C=C4S(=O)(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)/C=C/C3=NC4=C(O3)C=C(C=C4S(=O)(=O)O)C

InChI

InChI=1S/C18H14N2O5S/c1-10-3-4-12-13(7-10)24-16(19-12)5-6-17-20-18-14(25-17)8-11(2)9-15(18)26(21,22)23/h3-9H,1-2H3,(H,21,22,23)/b6-5+