3-oxidanyl-2-[5-(phenylmethyl)furan-2-yl]-3-(1H-1,2,4-triazol-5-yl)prop-1-en-1-one

Systemtic Name: 3-oxidanyl-2-[5-(phenylmethyl)furan-2-yl]-3-(1H-1,2,4-triazol-5-yl)prop-1-en-1-one Openeye Name: 2-(5-benzyl-2-furyl)-3-hydroxy-3-(1H-1,2,4-triazol-5-yl)prop-1-en-1-one CAS Name: 3-hydroxy-2-[5-(phenylmethyl)-2-furanyl]-3-(1H-1,2,4-triazol-5-yl)-1-propen-1-one IUPAC Name: 2-(5-benzylfuran-2-yl)-3-hydroxy-3-(1H-1,2,4-triazol-5-yl)prop-1-en-1-one Traditional Name: 2-(5-benzyl-2-furyl)-3-hydroxy-3-(1H-1,2,4-triazol-5-yl)prop-1-en-1-one Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(O2)C(=C=O)C(C3=NC=NN3)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(O2)C(=C=O)C(C3=NC=NN3)O

InChI

InChI=1S/C16H13N3O3/c20-9-13(15(21)16-17-10-18-19-16)14-7-6-12(22-14)8-11-4-2-1-3-5-11/h1-7,10,15,21H,8H2,(H,17,18,19)