4-[[3-(1,3-benzothiazol-2-yl)phenoxy]methyl]-6-chloranyl-chromen-2-one

Systemtic Name: 4-[[3-(1,3-benzothiazol-2-yl)phenoxy]methyl]-6-chloranyl-chromen-2-one Openeye Name: 4-[[3-(1,3-benzothiazol-2-yl)phenoxy]methyl]-6-chloro-chromen-2-one CAS Name: 4-[[3-(1,3-benzothiazol-2-yl)phenoxy]methyl]-6-chloro-1-benzopyran-2-one IUPAC Name: 4-[[3-(1,3-benzothiazol-2-yl)phenoxy]methyl]-6-chlorochromen-2-one Traditional Name: 4-[[3-(1,3-benzothiazol-2-yl)phenoxy]methyl]-6-chloro-coumarin Formula: C23H14ClNO3S MolecularWeight: 419.88016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)OCC4=CC(=O)OC5=C4C=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)OCC4=CC(=O)OC5=C4C=C(C=C5)Cl

InChI

InChI=1S/C23H14ClNO3S/c24-16-8-9-20-18(12-16)15(11-22(26)28-20)13-27-17-5-3-4-14(10-17)23-25-19-6-1-2-7-21(19)29-23/h1-12H,13H2