methyl 4-[[(3-butyl-5-ethenyl-2-phenyl-imidazol-4-yl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(3-butyl-5-ethenyl-2-phenyl-imidazol-4-yl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]methyl]benzoate Openeye Name: methyl 4-[[(3-butyl-2-phenyl-5-vinyl-imidazol-4-yl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]methyl]benzoate CAS Name: 4-[[(3-butyl-5-ethenyl-2-phenyl-4-imidazolyl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-butyl-5-ethenyl-2-phenylimidazol-4-yl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]methyl]benzoate Traditional Name: 4-[[(3-butyl-2-phenyl-5-vinyl-imidazol-4-yl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]methyl]benzoic acid methyl ester Formula: C34H37N3O4 MolecularWeight: 551.67528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1C2=CC=CC=C2)C=C)CN(CC3=CC=C(C=C3)C(=O)OC)CC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCCCN1C(=C(N=C1C2=CC=CC=C2)C=C)CN(CC3=CC=C(C=C3)C(=O)OC)CC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C34H37N3O4/c1-4-6-18-37-30(29(5-2)35-33(37)27-10-8-7-9-11-27)24-36(22-25-12-15-28(16-13-25)34(38)39-3)23-26-14-17-31-32(21-26)41-20-19-40-31/h5,7-17,21H,2,4,6,18-20,22-24H2,1,3H3