N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-piperidin-1-yl-aniline

Systemtic Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-piperidin-1-yl-aniline Openeye Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-(1-piperidyl)aniline CAS Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-(1-piperidinyl)aniline IUPAC Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline Traditional Name: 2-(3,4-dimethylphenoxy)ethyl-(2-nitro-5-piperidino-phenyl)amine Formula: C21H27N3O3 MolecularWeight: 369.45738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCNC2=C(C=CC(=C2)N3CCCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCNC2=C(C=CC(=C2)N3CCCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C21H27N3O3/c1-16-6-8-19(14-17(16)2)27-13-10-22-20-15-18(7-9-21(20)24(25)26)23-11-4-3-5-12-23/h6-9,14-15,22H,3-5,10-13H2,1-2H3