(2S)-6-(2-chloranylethanoyl)-4-(3-methylbutyl)-2-propan-2-yl-1,4-benzoxazin-3-one

Systemtic Name: (2S)-6-(2-chloranylethanoyl)-4-(3-methylbutyl)-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2S)-6-(2-chloroacetyl)-4-isopentyl-2-isopropyl-1,4-benzoxazin-3-one CAS Name: (2S)-6-(2-chloro-1-oxoethyl)-4-(3-methylbutyl)-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-(2-chloroacetyl)-4-(3-methylbutyl)-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2S)-6-(2-chloroacetyl)-4-isoamyl-2-isopropyl-1,4-benzoxazin-3-one Formula: C18H24ClNO3 MolecularWeight: 337.84106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=CC(=C2)C(=O)CCl)OC(C1=O)C(C)C

Isomeric SMILES

CC(C)CCN1C2=C(C=CC(=C2)C(=O)CCl)O[C@H](C1=O)C(C)C

InChI

InChI=1S/C18H24ClNO3/c1-11(2)7-8-20-14-9-13(15(21)10-19)5-6-16(14)23-17(12(3)4)18(20)22/h5-6,9,11-12,17H,7-8,10H2,1-4H3/t17-/m0/s1