ethyl 4-[[2-(imidazol-1-ylmethyl)pyrrol-1-yl]methyl]benzoate

Systemtic Name: ethyl 4-[[2-(imidazol-1-ylmethyl)pyrrol-1-yl]methyl]benzoate Openeye Name: ethyl 4-[[2-(imidazol-1-ylmethyl)pyrrol-1-yl]methyl]benzoate CAS Name: 4-[[2-(1-imidazolylmethyl)-1-pyrrolyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(imidazol-1-ylmethyl)pyrrol-1-yl]methyl]benzoate Traditional Name: 4-[[2-(imidazol-1-ylmethyl)pyrrol-1-yl]methyl]benzoic acid ethyl ester Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN2C=CC=C2CN3C=CN=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN2C=CC=C2CN3C=CN=C3

InChI

InChI=1S/C18H19N3O2/c1-2-23-18(22)16-7-5-15(6-8-16)12-21-10-3-4-17(21)13-20-11-9-19-14-20/h3-11,14H,2,12-13H2,1H3