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

Systemtic Name: methyl 3-[4-[3-(phenylmethyl)piperidin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[4-(3-benzyl-1-piperidyl)butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[3-(phenylmethyl)-1-piperidinyl]butyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-(3-benzylpiperidin-1-yl)butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-(3-benzylpiperidino)butyl]-1H-indole-5-carboxylic acid methyl ester Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O2/c1-30-26(29)22-12-13-25-24(17-22)23(18-27-25)11-5-6-14-28-15-7-10-21(19-28)16-20-8-3-2-4-9-20/h2-4,8-9,12-13,17-18,21,27H,5-7,10-11,14-16,19H2,1H3