(phenylmethyl) 4-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoate

Systemtic Name: (phenylmethyl) 4-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoate Openeye Name: benzyl 4-[[1-(imidazol-1-ylmethyl)-2-[(4-methoxyphenyl)methoxy]ethoxy]methyl]benzoate CAS Name: 4-[[1-(1-imidazolyl)-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[1-imidazol-1-yl-3-[(4-methoxyphenyl)methoxy]propan-2-yl]oxymethyl]benzoate Traditional Name: 4-[[1-(imidazol-1-ylmethyl)-2-p-anisyloxy-ethoxy]methyl]benzoic acid benzyl ester Formula: C29H30N2O5 MolecularWeight: 486.5589

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COCC(CN2C=CN=C2)OCC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)COCC(CN2C=CN=C2)OCC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H30N2O5/c1-33-27-13-9-24(10-14-27)18-34-21-28(17-31-16-15-30-22-31)35-19-25-7-11-26(12-8-25)29(32)36-20-23-5-3-2-4-6-23/h2-16,22,28H,17-21H2,1H3