N-[(1R)-1-phenylethyl]-1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[(1R)-1-phenylethyl]-1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-[(1R)-1-phenylethyl]-1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[(1R)-1-phenylethyl]-1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[(1R)-1-phenylethyl]-1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-[(1R)-1-phenylethyl]-1-(trifluoromethyl)-9H-$b-carboline-3-carboxamide Formula: C21H16F3N3O MolecularWeight: 383.36645

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C(F)(F)F

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C(F)(F)F

InChI

InChI=1S/C21H16F3N3O/c1-12(13-7-3-2-4-8-13)25-20(28)17-11-15-14-9-5-6-10-16(14)26-18(15)19(27-17)21(22,23)24/h2-12,26H,1H3,(H,25,28)/t12-/m1/s1