7-heptoxy-3-(6-methoxy-1,3-benzothiazol-2-yl)chromen-2-one

Systemtic Name: 7-heptoxy-3-(6-methoxy-1,3-benzothiazol-2-yl)chromen-2-one Openeye Name: 7-heptoxy-3-(6-methoxy-1,3-benzothiazol-2-yl)chromen-2-one CAS Name: 7-heptoxy-3-(6-methoxy-1,3-benzothiazol-2-yl)-1-benzopyran-2-one IUPAC Name: 7-heptoxy-3-(6-methoxy-1,3-benzothiazol-2-yl)chromen-2-one Traditional Name: 7-heptoxy-3-(6-methoxy-1,3-benzothiazol-2-yl)coumarin Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C24H25NO4S/c1-3-4-5-6-7-12-28-18-9-8-16-13-19(24(26)29-21(16)14-18)23-25-20-11-10-17(27-2)15-22(20)30-23/h8-11,13-15H,3-7,12H2,1-2H3