N-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[2-(5-benzyloxy-2-methyl-1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: 2-(5-benzoxy-2-methyl-1H-indol-3-yl)ethyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C25H22F3N3O3 MolecularWeight: 469.45569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)CCNC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)CCNC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C25H22F3N3O3/c1-16-20(11-12-29-23-9-7-18(25(26,27)28)13-24(23)31(32)33)21-14-19(8-10-22(21)30-16)34-15-17-5-3-2-4-6-17/h2-10,13-14,29-30H,11-12,15H2,1H3