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

Systemtic Name: (2R)-6-[(2S)-2-chloranylpropanoyl]-4-(phenylmethyl)-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2R)-4-benzyl-6-[(2S)-2-chloropropanoyl]-2-isopropyl-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(2S)-2-chloro-1-oxopropyl]-4-(phenylmethyl)-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2R)-4-benzyl-6-[(2S)-2-chloropropanoyl]-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2R)-4-benzyl-6-[(2S)-2-chloropropanoyl]-2-isopropyl-1,4-benzoxazin-3-one Formula: C21H22ClNO3 MolecularWeight: 371.85728

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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)CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC3=CC=CC=C3)C(C)C)Cl

InChI

InChI=1S/C21H22ClNO3/c1-13(2)20-21(25)23(12-15-7-5-4-6-8-15)17-11-16(19(24)14(3)22)9-10-18(17)26-20/h4-11,13-14,20H,12H2,1-3H3/t14-,20+/m0/s1