(2R)-6-[(2S)-2-chloranylpropanoyl]-4-(2-methylprop-2-enyl)-2-propan-2-yl-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-[(2S)-2-chloranylpropanoyl]-4-(2-methylprop-2-enyl)-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2R)-6-[(2S)-2-chloropropanoyl]-2-isopropyl-4-(2-methylallyl)-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(2S)-2-chloro-1-oxopropyl]-4-(2-methylprop-2-enyl)-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-[(2S)-2-chloropropanoyl]-4-(2-methylprop-2-enyl)-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-[(2S)-2-chloropropanoyl]-2-isopropyl-4-(2-methylallyl)-1,4-benzoxazin-3-one Formula: C18H22ClNO3 MolecularWeight: 335.82518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)C(C)Cl)CC(=C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClNO3/c1-10(2)9-20-14-8-13(16(21)12(5)19)6-7-15(14)23-17(11(3)4)18(20)22/h6-8,11-12,17H,1,9H2,2-5H3/t12-,17+/m0/s1