2-[(E)-2-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]ethenyl]-1,3-benzoxazole

Systemtic Name: 2-[(E)-2-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]ethenyl]-1,3-benzoxazole Openeye Name: 2-[(E)-2-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)vinyl]-1,3-benzoxazole CAS Name: 2-[(E)-2-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]ethenyl]-1,3-benzoxazole IUPAC Name: 2-[(E)-2-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)ethenyl]-1,3-benzoxazole Traditional Name: 2-[(E)-2-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)vinyl]-1,3-benzoxazole Formula: C20H16ClN3O MolecularWeight: 349.81354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC2=NC3=CC=CC=C3O2)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=C/C2=NC3=CC=CC=C3O2)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C20H16ClN3O/c1-14-16(11-12-19-22-17-9-5-6-10-18(17)25-19)20(21)24(23-14)13-15-7-3-2-4-8-15/h2-12H,13H2,1H3/b12-11+