ethyl 3-[3-[4-(phenylmethyl)piperidin-1-yl]propanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[3-[4-(phenylmethyl)piperidin-1-yl]propanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[3-(4-benzyl-1-piperidyl)propanoylamino]-1H-indole-2-carboxylate CAS Name: 3-[[1-oxo-3-[4-(phenylmethyl)-1-piperidinyl]propyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(4-benzylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate Traditional Name: 3-[3-(4-benzylpiperidino)propanoylamino]-1H-indole-2-carboxylic acid ethyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CCN3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CCN3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O3/c1-2-32-26(31)25-24(21-10-6-7-11-22(21)27-25)28-23(30)14-17-29-15-12-20(13-16-29)18-19-8-4-3-5-9-19/h3-11,20,27H,2,12-18H2,1H3,(H,28,30)