(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-naphthalen-2-ylsulfanylethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SCC(=O)OCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SCC(=O)OCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H15N3O3S/c24-19(12-27-16-10-9-14-5-1-2-6-15(14)11-16)26-13-23-20(25)17-7-3-4-8-18(17)21-22-23/h1-11H,12-13H2