ethyl 1-butyl-2-methyl-5-oxidanyl-4-prop-2-enyl-indole-3-carboxylate

Systemtic Name: ethyl 1-butyl-2-methyl-5-oxidanyl-4-prop-2-enyl-indole-3-carboxylate Openeye Name: ethyl 4-allyl-1-butyl-5-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 1-butyl-5-hydroxy-2-methyl-4-prop-2-enyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-5-hydroxy-2-methyl-4-prop-2-enylindole-3-carboxylate Traditional Name: 4-allyl-1-butyl-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C1C=CC(=C2CC=C)O)C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C2=C1C=CC(=C2CC=C)O)C(=O)OCC)C

InChI

InChI=1S/C19H25NO3/c1-5-8-12-20-13(4)17(19(22)23-7-3)18-14(9-6-2)16(21)11-10-15(18)20/h6,10-11,21H,2,5,7-9,12H2,1,3-4H3