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

Systemtic Name: methyl 3-[4-[3-[(4-ethylphenyl)methyl]piperidin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[4-[3-[(4-ethylphenyl)methyl]-1-piperidyl]butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[3-[(4-ethylphenyl)methyl]-1-piperidinyl]butyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-[3-[(4-ethylphenyl)methyl]piperidin-1-yl]butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-[3-(4-ethylbenzyl)piperidino]butyl]-1H-indole-5-carboxylic acid methyl ester Formula: C28H36N2O2 MolecularWeight: 432.59764

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2CCCN(C2)CCCCC3=CNC4=C3C=C(C=C4)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)CC2CCCN(C2)CCCCC3=CNC4=C3C=C(C=C4)C(=O)OC

InChI

InChI=1S/C28H36N2O2/c1-3-21-9-11-22(12-10-21)17-23-7-6-16-30(20-23)15-5-4-8-25-19-29-27-14-13-24(18-26(25)27)28(31)32-2/h9-14,18-19,23,29H,3-8,15-17,20H2,1-2H3