7-oxidanyl-3-[4-(4-pentylphenyl)-1,2,3-triazol-1-yl]chromen-2-one

Systemtic Name: 7-oxidanyl-3-[4-(4-pentylphenyl)-1,2,3-triazol-1-yl]chromen-2-one Openeye Name: 7-hydroxy-3-[4-(4-pentylphenyl)triazol-1-yl]chromen-2-one CAS Name: 7-hydroxy-3-[4-(4-pentylphenyl)-1-triazolyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-3-[4-(4-pentylphenyl)triazol-1-yl]chromen-2-one Traditional Name: 3-[4-(4-amylphenyl)triazol-1-yl]-7-hydroxy-coumarin Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CN(N=N2)C3=CC4=C(C=C(C=C4)O)OC3=O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CN(N=N2)C3=CC4=C(C=C(C=C4)O)OC3=O

InChI

InChI=1S/C22H21N3O3/c1-2-3-4-5-15-6-8-16(9-7-15)19-14-25(24-23-19)20-12-17-10-11-18(26)13-21(17)28-22(20)27/h6-14,26H,2-5H2,1H3