tert-butyl 2-(3-chloranylpropyl)-5-ethoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 2-(3-chloranylpropyl)-5-ethoxy-indole-1-carboxylate Openeye Name: tert-butyl 2-(3-chloropropyl)-5-ethoxy-indole-1-carboxylate CAS Name: 2-(3-chloropropyl)-5-ethoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-chloropropyl)-5-ethoxyindole-1-carboxylate Traditional Name: 2-(3-chloropropyl)-5-ethoxy-indole-1-carboxylic acid tert-butyl ester Formula: C18H24ClNO3 MolecularWeight: 337.84106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=C2)CCCCl)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=C2)CCCCl)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H24ClNO3/c1-5-22-15-8-9-16-13(12-15)11-14(7-6-10-19)20(16)17(21)23-18(2,3)4/h8-9,11-12H,5-7,10H2,1-4H3