2-(5-nitro-1H-indol-3-yl)-N-[(3-phenoxyphenyl)methyl]ethanamine

Systemtic Name: 2-(5-nitro-1H-indol-3-yl)-N-[(3-phenoxyphenyl)methyl]ethanamine Openeye Name: 2-(5-nitro-1H-indol-3-yl)-N-[(3-phenoxyphenyl)methyl]ethanamine CAS Name: 2-(5-nitro-1H-indol-3-yl)-N-[(3-phenoxyphenyl)methyl]ethanamine IUPAC Name: 2-(5-nitro-1H-indol-3-yl)-N-[(3-phenoxyphenyl)methyl]ethanamine Traditional Name: 2-(5-nitro-1H-indol-3-yl)ethyl-(3-phenoxybenzyl)amine Formula: C23H21N3O3 MolecularWeight: 387.43114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CNCCC3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CNCCC3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O3/c27-26(28)19-9-10-23-22(14-19)18(16-25-23)11-12-24-15-17-5-4-8-21(13-17)29-20-6-2-1-3-7-20/h1-10,13-14,16,24-25H,11-12,15H2