5-methoxy-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 5-methoxy-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 5-methoxy-N-(4-piperidylmethyl)-1H-indole-3-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: 5-methoxy-N-(4-piperidinylmethyl)-1H-indole-3-carboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: 5-methoxy-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: 5-methoxy-N-(4-piperidylmethyl)-1H-indole-3-carboxamide; 2,2,2-trifluoroacetic acid Formula: C18H22F3N3O4 MolecularWeight: 401.38019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C(=O)NCC3CCNCC3.C(=O)(C(F)(F)F)O

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2C(=O)NCC3CCNCC3.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C16H21N3O2.C2HF3O2/c1-21-12-2-3-15-13(8-12)14(10-18-15)16(20)19-9-11-4-6-17-7-5-11;3-2(4,5)1(6)7/h2-3,8,10-11,17-18H,4-7,9H2,1H3,(H,19,20);(H,6,7)