3-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]chromen-2-one

Systemtic Name: 3-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]chromen-2-one Openeye Name: 3-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]chromen-2-one CAS Name: 3-[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]chromen-2-one Traditional Name: 3-[2-(1,3-benzoxazol-2-ylthio)acetyl]coumarin Formula: C18H11NO4S MolecularWeight: 337.34924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C18H11NO4S/c20-14(10-24-18-19-13-6-2-4-8-16(13)23-18)12-9-11-5-1-3-7-15(11)22-17(12)21/h1-9H,10H2