1-[(E)-3-chloranylprop-2-enyl]-2,3-dimethyl-indole-5-carboxylate

Systemtic Name: 1-[(E)-3-chloranylprop-2-enyl]-2,3-dimethyl-indole-5-carboxylate Openeye Name: 1-[(E)-3-chloroallyl]-2,3-dimethyl-indole-5-carboxylate CAS Name: 1-[(E)-3-chloroprop-2-enyl]-2,3-dimethyl-5-indolecarboxylate IUPAC Name: 1-[(E)-3-chloroprop-2-enyl]-2,3-dimethylindole-5-carboxylate Traditional Name: 1-[(E)-3-chloroallyl]-2,3-dimethyl-indole-5-carboxylate Formula: C14H13ClNO2- MolecularWeight: 262.71152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)[O-])CC=CCl)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)[O-])C/C=C/Cl)C

InChI

InChI=1S/C14H14ClNO2/c1-9-10(2)16(7-3-6-15)13-5-4-11(14(17)18)8-12(9)13/h3-6,8H,7H2,1-2H3,(H,17,18)/p-1/b6-3+