3-[2-[(4-fluoranyl-2-methyl-phenyl)amino]-4-methyl-1,3-benzoxazol-6-yl]propanal

Systemtic Name: 3-[2-[(4-fluoranyl-2-methyl-phenyl)amino]-4-methyl-1,3-benzoxazol-6-yl]propanal Openeye Name: 3-[2-(4-fluoro-2-methyl-anilino)-4-methyl-1,3-benzoxazol-6-yl]propanal CAS Name: 3-[2-(4-fluoro-2-methylanilino)-4-methyl-1,3-benzoxazol-6-yl]propanal IUPAC Name: 3-[2-(4-fluoro-2-methylanilino)-4-methyl-1,3-benzoxazol-6-yl]propanal Traditional Name: 3-[2-(4-fluoro-2-methyl-anilino)-4-methyl-1,3-benzoxazol-6-yl]propionaldehyde Formula: C18H17FN2O2 MolecularWeight: 312.338183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC2=NC3=C(C=C(C=C3O2)CCC=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC2=NC3=C(C=C(C=C3O2)CCC=O)C

InChI

InChI=1S/C18H17FN2O2/c1-11-9-14(19)5-6-15(11)20-18-21-17-12(2)8-13(4-3-7-22)10-16(17)23-18/h5-10H,3-4H2,1-2H3,(H,20,21)