(4S)-6-chloranyl-4-(2-cyclopropylethynyl)-4-methyl-1H-3,1-benzoxazin-2-one

Systemtic Name: (4S)-6-chloranyl-4-(2-cyclopropylethynyl)-4-methyl-1H-3,1-benzoxazin-2-one Openeye Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-methyl-1H-3,1-benzoxazin-2-one CAS Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-methyl-1H-3,1-benzoxazin-2-one IUPAC Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-methyl-1H-3,1-benzoxazin-2-one Traditional Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-methyl-1H-3,1-benzoxazin-2-one Formula: C14H12ClNO2 MolecularWeight: 261.70358

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)Cl)NC(=O)O1)C#CC3CC3

Isomeric SMILES

C[C@@]1(C2=C(C=CC(=C2)Cl)NC(=O)O1)C#CC3CC3

InChI

InChI=1S/C14H12ClNO2/c1-14(7-6-9-2-3-9)11-8-10(15)4-5-12(11)16-13(17)18-14/h4-5,8-9H,2-3H2,1H3,(H,16,17)/t14-/m0/s1