[(2S)-2-(2-chloroethyl)-4-oxidanylidene-2H-1,3-benzoxazin-3-yl] 2-chloranylbenzoate

Systemtic Name: [(2S)-2-(2-chloroethyl)-4-oxidanylidene-2H-1,3-benzoxazin-3-yl] 2-chloranylbenzoate Openeye Name: [(2S)-2-(2-chloroethyl)-4-oxo-2H-1,3-benzoxazin-3-yl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [(2S)-2-(2-chloroethyl)-4-oxo-2H-1,3-benzoxazin-3-yl] ester IUPAC Name: [(2S)-2-(2-chloroethyl)-4-oxo-2H-1,3-benzoxazin-3-yl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [(2S)-2-(2-chloroethyl)-4-keto-2H-1,3-benzoxazin-3-yl] ester Formula: C17H13Cl2NO4 MolecularWeight: 366.19542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(O2)CCCl)OC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N([C@@H](O2)CCCl)OC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H13Cl2NO4/c18-10-9-15-20(16(21)12-6-2-4-8-14(12)23-15)24-17(22)11-5-1-3-7-13(11)19/h1-8,15H,9-10H2/t15-/m0/s1