ethyl 1-(4-chlorophenyl)-2-methyl-5-oxidanyl-4-prop-2-enyl-indole-3-carboxylate

Systemtic Name: ethyl 1-(4-chlorophenyl)-2-methyl-5-oxidanyl-4-prop-2-enyl-indole-3-carboxylate Openeye Name: ethyl 4-allyl-1-(4-chlorophenyl)-5-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 1-(4-chlorophenyl)-5-hydroxy-2-methyl-4-prop-2-enyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-chlorophenyl)-5-hydroxy-2-methyl-4-prop-2-enylindole-3-carboxylate Traditional Name: 4-allyl-1-(4-chlorophenyl)-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C21H20ClNO3 MolecularWeight: 369.8414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CC=C)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CC=C)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H20ClNO3/c1-4-6-16-18(24)12-11-17-20(16)19(21(25)26-5-2)13(3)23(17)15-9-7-14(22)8-10-15/h4,7-12,24H,1,5-6H2,2-3H3