8-(dimethylaminomethyl)-6-ethyl-7-oxidanyl-3-(4-phenyl-1,2,4-triazol-3-yl)chromen-4-one

Systemtic Name: 8-(dimethylaminomethyl)-6-ethyl-7-oxidanyl-3-(4-phenyl-1,2,4-triazol-3-yl)chromen-4-one Openeye Name: 8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-3-(4-phenyl-1,2,4-triazol-3-yl)chromen-4-one CAS Name: 8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-3-(4-phenyl-1,2,4-triazol-3-yl)-1-benzopyran-4-one IUPAC Name: 8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-3-(4-phenyl-1,2,4-triazol-3-yl)chromen-4-one Traditional Name: 8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-3-(4-phenyl-1,2,4-triazol-3-yl)chromone Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NN=CN3C4=CC=CC=C4)CN(C)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NN=CN3C4=CC=CC=C4)CN(C)C)O

InChI

InChI=1S/C22H22N4O3/c1-4-14-10-16-20(28)18(12-29-21(16)17(19(14)27)11-25(2)3)22-24-23-13-26(22)15-8-6-5-7-9-15/h5-10,12-13,27H,4,11H2,1-3H3