(phenylmethyl) 2-methyl-5-[2-(3-phenylpyrrolidin-1-yl)ethoxy]-1H-indole-3-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-5-[2-(3-phenylpyrrolidin-1-yl)ethoxy]-1H-indole-3-carboxylate Openeye Name: benzyl 2-methyl-5-[2-(3-phenylpyrrolidin-1-yl)ethoxy]-1H-indole-3-carboxylate CAS Name: 2-methyl-5-[2-(3-phenyl-1-pyrrolidinyl)ethoxy]-1H-indole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-5-[2-(3-phenylpyrrolidin-1-yl)ethoxy]-1H-indole-3-carboxylate Traditional Name: 2-methyl-5-[2-(3-phenylpyrrolidino)ethoxy]-1H-indole-3-carboxylic acid benzyl ester Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OCCN3CCC(C3)C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OCCN3CCC(C3)C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H30N2O3/c1-21-28(29(32)34-20-22-8-4-2-5-9-22)26-18-25(12-13-27(26)30-21)33-17-16-31-15-14-24(19-31)23-10-6-3-7-11-23/h2-13,18,24,30H,14-17,19-20H2,1H3