[3-(2-methylphenyl)carbonyloxy-5-(4-nitrophenoxy)oxolan-2-yl]methyl 2-methylbenzoate

Systemtic Name: [3-(2-methylphenyl)carbonyloxy-5-(4-nitrophenoxy)oxolan-2-yl]methyl 2-methylbenzoate Openeye Name: [3-(2-methylbenzoyl)oxy-5-(4-nitrophenoxy)tetrahydrofuran-2-yl]methyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid [3-[(2-methylphenyl)-oxomethoxy]-5-(4-nitrophenoxy)-2-oxolanyl]methyl ester IUPAC Name: [3-(2-methylbenzoyl)oxy-5-(4-nitrophenoxy)oxolan-2-yl]methyl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [5-(4-nitrophenoxy)-3-o-toluoyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C27H25NO8 MolecularWeight: 491.4893

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OCC2C(CC(O2)OC3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=CC=C4C

Isomeric SMILES

CC1=CC=CC=C1C(=O)OCC2C(CC(O2)OC3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=CC=C4C

InChI

InChI=1S/C27H25NO8/c1-17-7-3-5-9-21(17)26(29)33-16-24-23(36-27(30)22-10-6-4-8-18(22)2)15-25(35-24)34-20-13-11-19(12-14-20)28(31)32/h3-14,23-25H,15-16H2,1-2H3