3-(2-nitroindol-1-yl)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]propan-1-amine

Systemtic Name: 3-(2-nitroindol-1-yl)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]propan-1-amine Openeye Name: 3-(2-nitroindol-1-yl)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]propan-1-amine CAS Name: 3-(2-nitro-1-indolyl)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]-1-propanamine IUPAC Name: 3-(2-nitroindol-1-yl)-N,N-bis[[3-(trifluoromethyl)phenyl]methyl]propan-1-amine Traditional Name: 3-(2-nitroindol-1-yl)propyl-bis[3-(trifluoromethyl)benzyl]amine Formula: C27H23F6N3O2 MolecularWeight: 535.480839

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2CCCN(CC3=CC(=CC=C3)C(F)(F)F)CC4=CC(=CC=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2CCCN(CC3=CC(=CC=C3)C(F)(F)F)CC4=CC(=CC=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C27H23F6N3O2/c28-26(29,30)22-9-3-6-19(14-22)17-34(18-20-7-4-10-23(15-20)27(31,32)33)12-5-13-35-24-11-2-1-8-21(24)16-25(35)36(37)38/h1-4,6-11,14-16H,5,12-13,17-18H2