methyl 1-(3-chloranylpropyl)-3-(imidazol-1-ylmethyl)indole-7-carboxylate

Systemtic Name: methyl 1-(3-chloranylpropyl)-3-(imidazol-1-ylmethyl)indole-7-carboxylate Openeye Name: methyl 1-(3-chloropropyl)-3-(imidazol-1-ylmethyl)indole-7-carboxylate CAS Name: 1-(3-chloropropyl)-3-(1-imidazolylmethyl)-7-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-chloropropyl)-3-(imidazol-1-ylmethyl)indole-7-carboxylate Traditional Name: 1-(3-chloropropyl)-3-(imidazol-1-ylmethyl)indole-7-carboxylic acid methyl ester Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC2=C1N(C=C2CN3C=CN=C3)CCCCl

Isomeric SMILES

COC(=O)C1=CC=CC2=C1N(C=C2CN3C=CN=C3)CCCCl

InChI

InChI=1S/C17H18ClN3O2/c1-23-17(22)15-5-2-4-14-13(10-20-9-7-19-12-20)11-21(16(14)15)8-3-6-18/h2,4-5,7,9,11-12H,3,6,8,10H2,1H3