ethyl 4-[[3-(imidazol-1-ylmethyl)indol-1-yl]methyl]benzoate

Systemtic Name: ethyl 4-[[3-(imidazol-1-ylmethyl)indol-1-yl]methyl]benzoate Openeye Name: ethyl 4-[[3-(imidazol-1-ylmethyl)indol-1-yl]methyl]benzoate CAS Name: 4-[[3-(1-imidazolylmethyl)-1-indolyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(imidazol-1-ylmethyl)indol-1-yl]methyl]benzoate Traditional Name: 4-[[3-(imidazol-1-ylmethyl)indol-1-yl]methyl]benzoic acid ethyl ester Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)CN4C=CN=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)CN4C=CN=C4

InChI

InChI=1S/C22H21N3O2/c1-2-27-22(26)18-9-7-17(8-10-18)13-25-15-19(14-24-12-11-23-16-24)20-5-3-4-6-21(20)25/h3-12,15-16H,2,13-14H2,1H3