3-(1,3-benzothiazol-2-yl)-6-hexyl-7-oxidanyl-chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-6-hexyl-7-oxidanyl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-6-hexyl-7-hydroxy-chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-6-hexyl-7-hydroxy-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-6-hexyl-7-hydroxy-chromone Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4S3)O

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C22H21NO3S/c1-2-3-4-5-8-14-11-15-19(12-18(14)24)26-13-16(21(15)25)22-23-17-9-6-7-10-20(17)27-22/h6-7,9-13,24H,2-5,8H2,1H3