(2S)-6-bromanyl-2-(2-phenyl-1,2,3-triazol-4-yl)-2,3-dihydrochromen-4-one

Systemtic Name: (2S)-6-bromanyl-2-(2-phenyl-1,2,3-triazol-4-yl)-2,3-dihydrochromen-4-one Openeye Name: (2S)-6-bromo-2-(2-phenyltriazol-4-yl)chroman-4-one CAS Name: (2S)-6-bromo-2-(2-phenyl-4-triazolyl)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (2S)-6-bromo-2-(2-phenyltriazol-4-yl)-2,3-dihydrochromen-4-one Traditional Name: (2S)-6-bromo-2-(2-phenyltriazol-4-yl)chroman-4-one Formula: C17H12BrN3O2 MolecularWeight: 370.20008

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(C1=O)C=C(C=C2)Br)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1[C@H](OC2=C(C1=O)C=C(C=C2)Br)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C17H12BrN3O2/c18-11-6-7-16-13(8-11)15(22)9-17(23-16)14-10-19-21(20-14)12-4-2-1-3-5-12/h1-8,10,17H,9H2/t17-/m0/s1