6-[(2S)-2-chloranylpropanoyl]-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)COC3=C2C=C(C=C3)C(=O)C(C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)COC3=C2C=C(C=C3)C(=O)[C@H](C)Cl

InChI

InChI=1S/C19H18ClNO3/c1-12-3-5-14(6-4-12)10-21-16-9-15(19(23)13(2)20)7-8-17(16)24-11-18(21)22/h3-9,13H,10-11H2,1-2H3/t13-/m0/s1