3-(5-chloranyl-1,4,4-trimethyl-2-oxidanylidene-3,1-benzoxazin-6-yl)benzenecarbonitrile

Systemtic Name: 3-(5-chloranyl-1,4,4-trimethyl-2-oxidanylidene-3,1-benzoxazin-6-yl)benzenecarbonitrile Openeye Name: 3-(5-chloro-1,4,4-trimethyl-2-oxo-3,1-benzoxazin-6-yl)benzonitrile CAS Name: 3-(5-chloro-1,4,4-trimethyl-2-oxo-3,1-benzoxazin-6-yl)benzonitrile IUPAC Name: 3-(5-chloro-1,4,4-trimethyl-2-oxo-3,1-benzoxazin-6-yl)benzonitrile Traditional Name: 3-(5-chloro-2-keto-1,4,4-trimethyl-3,1-benzoxazin-6-yl)benzonitrile Formula: C18H15ClN2O2 MolecularWeight: 326.7769

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2Cl)C3=CC=CC(=C3)C#N)N(C(=O)O1)C)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2Cl)C3=CC=CC(=C3)C#N)N(C(=O)O1)C)C

InChI

InChI=1S/C18H15ClN2O2/c1-18(2)15-14(21(3)17(22)23-18)8-7-13(16(15)19)12-6-4-5-11(9-12)10-20/h4-9H,1-3H3