(phenylmethyl) 2-methyl-5-oxidanyl-1-propyl-indole-3-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-5-oxidanyl-1-propyl-indole-3-carboxylate Openeye Name: benzyl 5-hydroxy-2-methyl-1-propyl-indole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-1-propyl-3-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-hydroxy-2-methyl-1-propylindole-3-carboxylate Traditional Name: 5-hydroxy-2-methyl-1-propyl-indole-3-carboxylic acid benzyl ester Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=C1C=CC(=C2)O)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CCCN1C(=C(C2=C1C=CC(=C2)O)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C20H21NO3/c1-3-11-21-14(2)19(17-12-16(22)9-10-18(17)21)20(23)24-13-15-7-5-4-6-8-15/h4-10,12,22H,3,11,13H2,1-2H3