4-[3,5-bis(trifluoromethyl)phenyl]carbonyl-N-ethyl-3-(1H-indol-3-ylmethyl)piperazine-1-carboxamide; (2-methoxyphenyl)methanamine

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenyl]carbonyl-N-ethyl-3-(1H-indol-3-ylmethyl)piperazine-1-carboxamide; (2-methoxyphenyl)methanamine Openeye Name: 4-[3,5-bis(trifluoromethyl)benzoyl]-N-ethyl-3-(1H-indol-3-ylmethyl)piperazine-1-carboxamide; (2-methoxyphenyl)methanamine CAS Name: 4-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-N-ethyl-3-(1H-indol-3-ylmethyl)-1-piperazinecarboxamide; (2-methoxyphenyl)methanamine IUPAC Name: 4-[3,5-bis(trifluoromethyl)benzoyl]-N-ethyl-3-(1H-indol-3-ylmethyl)piperazine-1-carboxamide; (2-methoxyphenyl)methanamine Traditional Name: 4-[3,5-bis(trifluoromethyl)benzoyl]-N-ethyl-3-(1H-indol-3-ylmethyl)piperazine-1-carboxamide; o-anisylamine Formula: C33H35F6N5O3 MolecularWeight: 663.653119

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(C(C1)CC2=CNC3=CC=CC=C32)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F.COC1=CC=CC=C1CN

Isomeric SMILES

CCNC(=O)N1CCN(C(C1)CC2=CNC3=CC=CC=C32)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F.COC1=CC=CC=C1CN

InChI

InChI=1S/C25H24F6N4O2.C8H11NO/c1-2-32-23(37)34-7-8-35(19(14-34)11-16-13-33-21-6-4-3-5-20(16)21)22(36)15-9-17(24(26,27)28)12-18(10-15)25(29,30)31;1-10-8-5-3-2-4-7(8)6-9/h3-6,9-10,12-13,19,33H,2,7-8,11,14H2,1H3,(H,32,37);2-5H,6,9H2,1H3