N-[1-(3,5-dimethylphenyl)ethyl]-2-nitro-5-piperazin-1-yl-aniline

Systemtic Name: N-[1-(3,5-dimethylphenyl)ethyl]-2-nitro-5-piperazin-1-yl-aniline Openeye Name: N-[1-(3,5-dimethylphenyl)ethyl]-2-nitro-5-piperazin-1-yl-aniline CAS Name: N-[1-(3,5-dimethylphenyl)ethyl]-2-nitro-5-(1-piperazinyl)aniline IUPAC Name: N-[1-(3,5-dimethylphenyl)ethyl]-2-nitro-5-piperazin-1-ylaniline Traditional Name: 1-(3,5-dimethylphenyl)ethyl-(2-nitro-5-piperazino-phenyl)amine Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C)NC2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C)NC2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-])C

InChI

InChI=1S/C20H26N4O2/c1-14-10-15(2)12-17(11-14)16(3)22-19-13-18(4-5-20(19)24(25)26)23-8-6-21-7-9-23/h4-5,10-13,16,21-22H,6-9H2,1-3H3