2-(aminomethyl)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-phenyl-quinoline-3-carboxamide

Systemtic Name: 2-(aminomethyl)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-phenyl-quinoline-3-carboxamide Openeye Name: 2-(aminomethyl)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-phenyl-quinoline-3-carboxamide CAS Name: 2-(aminomethyl)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-phenyl-3-quinolinecarboxamide IUPAC Name: 2-(aminomethyl)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-phenylquinoline-3-carboxamide Traditional Name: 2-(aminomethyl)-N-[3,5-bis(trifluoromethyl)benzyl]-4-phenyl-quinoline-3-carboxamide Formula: C26H19F6N3O MolecularWeight: 503.438979

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC3=CC=CC=C32)CN)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC3=CC=CC=C32)CN)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C26H19F6N3O/c27-25(28,29)17-10-15(11-18(12-17)26(30,31)32)14-34-24(36)23-21(13-33)35-20-9-5-4-8-19(20)22(23)16-6-2-1-3-7-16/h1-12H,13-14,33H2,(H,34,36)