ethyl 1-(3-chloranylpropyl)-5-(imidazol-1-ylmethyl)indole-2-carboxylate

Systemtic Name: ethyl 1-(3-chloranylpropyl)-5-(imidazol-1-ylmethyl)indole-2-carboxylate Openeye Name: ethyl 1-(3-chloropropyl)-5-(imidazol-1-ylmethyl)indole-2-carboxylate CAS Name: 1-(3-chloropropyl)-5-(1-imidazolylmethyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-chloropropyl)-5-(imidazol-1-ylmethyl)indole-2-carboxylate Traditional Name: 1-(3-chloropropyl)-5-(imidazol-1-ylmethyl)indole-2-carboxylic acid ethyl ester Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CCCCl)C=CC(=C2)CN3C=CN=C3

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CCCCl)C=CC(=C2)CN3C=CN=C3

InChI

InChI=1S/C18H20ClN3O2/c1-2-24-18(23)17-11-15-10-14(12-21-9-7-20-13-21)4-5-16(15)22(17)8-3-6-19/h4-5,7,9-11,13H,2-3,6,8,12H2,1H3