ethyl 2-methyl-5-oxidanyl-1-(3-phenylpropyl)indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-oxidanyl-1-(3-phenylpropyl)indole-3-carboxylate Openeye Name: ethyl 5-hydroxy-2-methyl-1-(3-phenylpropyl)indole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-1-(3-phenylpropyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-1-(3-phenylpropyl)indole-3-carboxylate Traditional Name: 5-hydroxy-2-methyl-1-(3-phenylpropyl)indole-3-carboxylic acid ethyl ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCCC3=CC=CC=C3)C

InChI

InChI=1S/C21H23NO3/c1-3-25-21(24)20-15(2)22(19-12-11-17(23)14-18(19)20)13-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-12,14,23H,3,7,10,13H2,1-2H3