methyl 2-[1-[(4-chlorophenyl)methyl]indol-3-yl]carbonyl-1H-imidazole-5-carboxylate

Systemtic Name: methyl 2-[1-[(4-chlorophenyl)methyl]indol-3-yl]carbonyl-1H-imidazole-5-carboxylate Openeye Name: methyl 2-[1-[(4-chlorophenyl)methyl]indole-3-carbonyl]-1H-imidazole-5-carboxylate CAS Name: 2-[[1-[(4-chlorophenyl)methyl]-3-indolyl]-oxomethyl]-1H-imidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[1-[(4-chlorophenyl)methyl]indole-3-carbonyl]-1H-imidazole-5-carboxylate Traditional Name: 2-[1-(4-chlorobenzyl)indole-3-carbonyl]-1H-imidazole-5-carboxylic acid methyl ester Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N1)C(=O)C2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=CN=C(N1)C(=O)C2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClN3O3/c1-28-21(27)17-10-23-20(24-17)19(26)16-12-25(18-5-3-2-4-15(16)18)11-13-6-8-14(22)9-7-13/h2-10,12H,11H2,1H3,(H,23,24)