[6-acetyloxy-3-(2-chlorophenyl)-1-ethanoyl-5-undecyl-4,1,2-benzoxadiazin-7-yl] ethanoate

Systemtic Name: [6-acetyloxy-3-(2-chlorophenyl)-1-ethanoyl-5-undecyl-4,1,2-benzoxadiazin-7-yl] ethanoate Openeye Name: [6-acetoxy-1-acetyl-3-(2-chlorophenyl)-5-undecyl-4,1,2-benzoxadiazin-7-yl] acetate CAS Name: acetic acid [1-acetyl-6-acetyloxy-3-(2-chlorophenyl)-5-undecyl-4,1,2-benzoxadiazin-7-yl] ester IUPAC Name: [1-acetyl-6-acetyloxy-3-(2-chlorophenyl)-5-undecyl-4,1,2-benzoxadiazin-7-yl] acetate Traditional Name: acetic acid [6-acetoxy-1-acetyl-3-(2-chlorophenyl)-5-undecyl-4,1,2-benzoxadiazin-7-yl] ester Formula: C30H37ClN2O6 MolecularWeight: 557.07758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=C2C(=CC(=C1OC(=O)C)OC(=O)C)N(N=C(O2)C3=CC=CC=C3Cl)C(=O)C

Isomeric SMILES

CCCCCCCCCCCC1=C2C(=CC(=C1OC(=O)C)OC(=O)C)N(N=C(O2)C3=CC=CC=C3Cl)C(=O)C

InChI

InChI=1S/C30H37ClN2O6/c1-5-6-7-8-9-10-11-12-13-17-24-28-26(19-27(37-21(3)35)29(24)38-22(4)36)33(20(2)34)32-30(39-28)23-16-14-15-18-25(23)31/h14-16,18-19H,5-13,17H2,1-4H3