[5-methoxy-2-nitro-4-(3-oxidanylpropoxy)phenyl]methyl 5-[bis(4-methoxyphenyl)-phenyl-methoxy]pentanoate

Systemtic Name: [5-methoxy-2-nitro-4-(3-oxidanylpropoxy)phenyl]methyl 5-[bis(4-methoxyphenyl)-phenyl-methoxy]pentanoate Openeye Name: [4-(3-hydroxypropoxy)-5-methoxy-2-nitro-phenyl]methyl 5-[bis(4-methoxyphenyl)-phenyl-methoxy]pentanoate CAS Name: 5-[bis(4-methoxyphenyl)-phenylmethoxy]pentanoic acid [4-(3-hydroxypropoxy)-5-methoxy-2-nitrophenyl]methyl ester IUPAC Name: [4-(3-hydroxypropoxy)-5-methoxy-2-nitrophenyl]methyl 5-[bis(4-methoxyphenyl)-phenylmethoxy]pentanoate Traditional Name: 5-[bis(4-methoxyphenyl)-phenyl-methoxy]valeric acid [4-(3-hydroxypropoxy)-5-methoxy-2-nitro-benzyl] ester Formula: C37H41NO10 MolecularWeight: 659.72214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCCCCC(=O)OCC4=CC(=C(C=C4[N+](=O)[O-])OCCCO)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCCCCC(=O)OCC4=CC(=C(C=C4[N+](=O)[O-])OCCCO)OC

InChI

InChI=1S/C37H41NO10/c1-43-31-17-13-29(14-18-31)37(28-10-5-4-6-11-28,30-15-19-32(44-2)20-16-30)48-23-8-7-12-36(40)47-26-27-24-34(45-3)35(46-22-9-21-39)25-33(27)38(41)42/h4-6,10-11,13-20,24-25,39H,7-9,12,21-23,26H2,1-3H3