3-(3H-1,3-benzothiazol-2-ylidene)-6-hexyl-chromene-2,7-dione

Systemtic Name: 3-(3H-1,3-benzothiazol-2-ylidene)-6-hexyl-chromene-2,7-dione Openeye Name: 3-(3H-1,3-benzothiazol-2-ylidene)-6-hexyl-chromene-2,7-dione CAS Name: 3-(3H-1,3-benzothiazol-2-ylidene)-6-hexyl-1-benzopyran-2,7-dione IUPAC Name: 3-(3H-1,3-benzothiazol-2-ylidene)-6-hexylchromene-2,7-dione Traditional Name: 3-(3H-1,3-benzothiazol-2-ylidene)-6-hexyl-chromene-2,7-quinone Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=CC(=C3NC4=CC=CC=C4S3)C(=O)OC2=CC1=O

Isomeric SMILES

CCCCCCC1=CC2=CC(=C3NC4=CC=CC=C4S3)C(=O)OC2=CC1=O

InChI

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