6-[(2S)-2-chloranylpropanoyl]-2,2-dimethyl-4-prop-2-enyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2S)-2-chloranylpropanoyl]-2,2-dimethyl-4-prop-2-enyl-1,4-benzoxazin-3-one Openeye Name: 4-allyl-6-[(2S)-2-chloropropanoyl]-2,2-dimethyl-1,4-benzoxazin-3-one CAS Name: 6-[(2S)-2-chloro-1-oxopropyl]-2,2-dimethyl-4-prop-2-enyl-1,4-benzoxazin-3-one IUPAC Name: 6-[(2S)-2-chloropropanoyl]-2,2-dimethyl-4-prop-2-enyl-1,4-benzoxazin-3-one Traditional Name: 4-allyl-6-[(2S)-2-chloropropanoyl]-2,2-dimethyl-1,4-benzoxazin-3-one Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC=C)(C)C)Cl

Isomeric SMILES

C[C@@H](C(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC=C)(C)C)Cl

InChI

InChI=1S/C16H18ClNO3/c1-5-8-18-12-9-11(14(19)10(2)17)6-7-13(12)21-16(3,4)15(18)20/h5-7,9-10H,1,8H2,2-4H3/t10-/m0/s1