ethyl 5-chloranyl-1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]indole-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]indole-2-carboxylate Openeye Name: ethyl 5-chloro-1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]indole-2-carboxylate CAS Name: 5-chloro-1-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]indole-2-carboxylate Traditional Name: 5-chloro-1-[[3-(4-cyanobenzyl)imidazol-4-yl]methyl]indole-2-carboxylic acid ethyl ester Formula: C23H19ClN4O2 MolecularWeight: 418.87556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC3=CN=CN3CC4=CC=C(C=C4)C#N)C=CC(=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC3=CN=CN3CC4=CC=C(C=C4)C#N)C=CC(=C2)Cl

InChI

InChI=1S/C23H19ClN4O2/c1-2-30-23(29)22-10-18-9-19(24)7-8-21(18)28(22)14-20-12-26-15-27(20)13-17-5-3-16(11-25)4-6-17/h3-10,12,15H,2,13-14H2,1H3