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

Systemtic Name: (2S)-6-[(2S)-2-chloranylpropanoyl]-4-pentyl-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2S)-6-[(2S)-2-chloropropanoyl]-2-isopropyl-4-pentyl-1,4-benzoxazin-3-one CAS Name: (2S)-6-[(2S)-2-chloro-1-oxopropyl]-4-pentyl-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-[(2S)-2-chloropropanoyl]-4-pentyl-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2S)-4-amyl-6-[(2S)-2-chloropropanoyl]-2-isopropyl-1,4-benzoxazin-3-one Formula: C19H26ClNO3 MolecularWeight: 351.86764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=CC(=C2)C(=O)C(C)Cl)OC(C1=O)C(C)C

Isomeric SMILES

CCCCCN1C2=C(C=CC(=C2)C(=O)[C@H](C)Cl)O[C@H](C1=O)C(C)C

InChI

InChI=1S/C19H26ClNO3/c1-5-6-7-10-21-15-11-14(17(22)13(4)20)8-9-16(15)24-18(12(2)3)19(21)23/h8-9,11-13,18H,5-7,10H2,1-4H3/t13-,18-/m0/s1