methyl 3-[4-[3-[(4-fluorophenyl)methyl]piperidin-1-yl]butyl]-1H-indole-5-carboxylate

Systemtic Name: methyl 3-[4-[3-[(4-fluorophenyl)methyl]piperidin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[4-[3-[(4-fluorophenyl)methyl]-1-piperidyl]butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[3-[(4-fluorophenyl)methyl]-1-piperidinyl]butyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-[3-[(4-fluorophenyl)methyl]piperidin-1-yl]butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-[3-(4-fluorobenzyl)piperidino]butyl]-1H-indole-5-carboxylic acid methyl ester Formula: C26H31FN2O2 MolecularWeight: 422.534943

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCCC(C3)CC4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCCC(C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C26H31FN2O2/c1-31-26(30)21-9-12-25-24(16-21)22(17-28-25)6-2-3-13-29-14-4-5-20(18-29)15-19-7-10-23(27)11-8-19/h7-12,16-17,20,28H,2-6,13-15,18H2,1H3