(2S)-6-(2-chloranylethanoyl)-4-(3-oxidanylpropyl)-2-phenyl-1,4-benzoxazin-3-one

Systemtic Name: (2S)-6-(2-chloranylethanoyl)-4-(3-oxidanylpropyl)-2-phenyl-1,4-benzoxazin-3-one Openeye Name: (2S)-6-(2-chloroacetyl)-4-(3-hydroxypropyl)-2-phenyl-1,4-benzoxazin-3-one CAS Name: (2S)-6-(2-chloro-1-oxoethyl)-4-(3-hydroxypropyl)-2-phenyl-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-(2-chloroacetyl)-4-(3-hydroxypropyl)-2-phenyl-1,4-benzoxazin-3-one Traditional Name: (2S)-6-(2-chloroacetyl)-4-(3-hydroxypropyl)-2-phenyl-1,4-benzoxazin-3-one Formula: C19H18ClNO4 MolecularWeight: 359.80352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=O)N(C3=C(O2)C=CC(=C3)C(=O)CCl)CCCO

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2C(=O)N(C3=C(O2)C=CC(=C3)C(=O)CCl)CCCO

InChI

InChI=1S/C19H18ClNO4/c20-12-16(23)14-7-8-17-15(11-14)21(9-4-10-22)19(24)18(25-17)13-5-2-1-3-6-13/h1-3,5-8,11,18,22H,4,9-10,12H2/t18-/m0/s1