5-(1,3-benzoxazol-2-yl)-3-chloranyl-7-(diethylamino)-2-oxidanylidene-chromene-4-carbonitrile

Systemtic Name: 5-(1,3-benzoxazol-2-yl)-3-chloranyl-7-(diethylamino)-2-oxidanylidene-chromene-4-carbonitrile Openeye Name: 5-(1,3-benzoxazol-2-yl)-3-chloro-7-(diethylamino)-2-oxo-chromene-4-carbonitrile CAS Name: 5-(1,3-benzoxazol-2-yl)-3-chloro-7-(diethylamino)-2-oxo-1-benzopyran-4-carbonitrile IUPAC Name: 5-(1,3-benzoxazol-2-yl)-3-chloro-7-(diethylamino)-2-oxochromene-4-carbonitrile Traditional Name: 5-(1,3-benzoxazol-2-yl)-3-chloro-7-(diethylamino)-2-keto-chromene-4-carbonitrile Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C(=C1)C3=NC4=CC=CC=C4O3)C(=C(C(=O)O2)Cl)C#N

Isomeric SMILES

CCN(CC)C1=CC2=C(C(=C1)C3=NC4=CC=CC=C4O3)C(=C(C(=O)O2)Cl)C#N

InChI

InChI=1S/C21H16ClN3O3/c1-3-25(4-2)12-9-13(20-24-15-7-5-6-8-16(15)27-20)18-14(11-23)19(22)21(26)28-17(18)10-12/h5-10H,3-4H2,1-2H3