[5-oxidanylidene-1,3,4-tris(phenylmethoxy)pentan-2-yl] 4-nitrobenzoate

Systemtic Name: [5-oxidanylidene-1,3,4-tris(phenylmethoxy)pentan-2-yl] 4-nitrobenzoate Openeye Name: [2,3-dibenzyloxy-1-(benzyloxymethyl)-4-oxo-butyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [5-oxo-1,3,4-tris(phenylmethoxy)pentan-2-yl] ester IUPAC Name: [5-oxo-1,3,4-tris(phenylmethoxy)pentan-2-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2,3-dibenzoxy-1-(benzoxymethyl)-4-keto-butyl] ester Formula: C33H31NO8 MolecularWeight: 569.60114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(C(C(C=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COCC(C(C(C=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C33H31NO8/c35-20-30(40-22-26-12-6-2-7-13-26)32(41-23-27-14-8-3-9-15-27)31(24-39-21-25-10-4-1-5-11-25)42-33(36)28-16-18-29(19-17-28)34(37)38/h1-20,30-32H,21-24H2