N-butyl-N-[2-[4-(4-chlorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-butyl-N-[2-[4-(4-chlorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-butyl-N-[2-[4-(4-chlorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-butyl-N-[2-[4-(4-chlorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-butyl-N-[2-[4-(4-chlorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-butyl-N-[2-[4-(4-chlorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-keto-ethyl]-3-(trifluoromethyl)benzamide Formula: C31H27ClF3N3O2 MolecularWeight: 566.01319

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)Cl)C(=O)C5=CC(=CC=C5)C(F)(F)F

Isomeric SMILES

CCCCN(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)Cl)C(=O)C5=CC(=CC=C5)C(F)(F)F

InChI

InChI=1S/C31H27ClF3N3O2/c1-2-3-17-36(30(40)22-8-6-9-23(19-22)31(33,34)35)20-28(39)38-26-11-5-4-10-25(26)37-18-7-12-27(37)29(38)21-13-15-24(32)16-14-21/h4-16,18-19,29H,2-3,17,20H2,1H3