6-(3-ethynylphenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-(3-ethynylphenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-(3-ethynylphenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-(3-ethynylphenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-(3-ethynylphenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-(3-ethynylphenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Formula: C18H15NO2 MolecularWeight: 277.3172

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC=CC(=C3)C#C)NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC=CC(=C3)C#C)NC(=O)O1)C

InChI

InChI=1S/C18H15NO2/c1-4-12-6-5-7-13(10-12)14-8-9-16-15(11-14)18(2,3)21-17(20)19-16/h1,5-11H,2-3H3,(H,19,20)