6-[(2S)-2-chloranylpropanoyl]-4-[(1R)-1-phenylethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2S)-2-chloranylpropanoyl]-4-[(1R)-1-phenylethyl]-1,4-benzoxazin-3-one Openeye Name: 6-[(2S)-2-chloropropanoyl]-4-[(1R)-1-phenylethyl]-1,4-benzoxazin-3-one CAS Name: 6-[(2S)-2-chloro-1-oxopropyl]-4-[(1R)-1-phenylethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-[(2S)-2-chloropropanoyl]-4-[(1R)-1-phenylethyl]-1,4-benzoxazin-3-one Traditional Name: 6-[(2S)-2-chloropropanoyl]-4-[(1R)-1-phenylethyl]-1,4-benzoxazin-3-one Formula: C19H18ClNO3 MolecularWeight: 343.80412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)COC3=C2C=C(C=C3)C(=O)C(C)Cl

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C(=O)COC3=C2C=C(C=C3)C(=O)[C@H](C)Cl

InChI

InChI=1S/C19H18ClNO3/c1-12(20)19(23)15-8-9-17-16(10-15)21(18(22)11-24-17)13(2)14-6-4-3-5-7-14/h3-10,12-13H,11H2,1-2H3/t12-,13+/m0/s1