N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-5-(2-methoxyphenyl)isoxazole-3-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-5-(2-methoxyphenyl)-3-isoxazolecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-5-(2-methoxyphenyl)isoxazole-3-carboxamide Formula: C25H19N3O6 MolecularWeight: 457.43486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NO2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NO2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H19N3O6/c1-31-20-9-5-3-7-17(20)22-13-19(28-34-22)25(30)27-18-8-4-2-6-16(18)24(29)26-15-10-11-21-23(12-15)33-14-32-21/h2-13H,14H2,1H3,(H,26,29)(H,27,30)