2-[3-(1,3-benzothiazol-2-yl)-2-oxidanylidene-chromen-7-yl]oxyethanenitrile

Systemtic Name: 2-[3-(1,3-benzothiazol-2-yl)-2-oxidanylidene-chromen-7-yl]oxyethanenitrile Openeye Name: 2-[3-(1,3-benzothiazol-2-yl)-2-oxo-chromen-7-yl]oxyacetonitrile CAS Name: 2-[[3-(1,3-benzothiazol-2-yl)-2-oxo-1-benzopyran-7-yl]oxy]acetonitrile IUPAC Name: 2-[3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl]oxyacetonitrile Traditional Name: 2-[3-(1,3-benzothiazol-2-yl)-2-keto-chromen-7-yl]oxyacetonitrile Formula: C18H10N2O3S MolecularWeight: 334.3486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C(C=C4)OCC#N)OC3=O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C(C=C4)OCC#N)OC3=O

InChI

InChI=1S/C18H10N2O3S/c19-7-8-22-12-6-5-11-9-13(18(21)23-15(11)10-12)17-20-14-3-1-2-4-16(14)24-17/h1-6,9-10H,8H2