2-[(2-methyl-5-nitro-phenyl)amino]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)amino]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(2-methyl-5-nitro-anilino)-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-(2-methyl-5-nitroanilino)-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(2-methyl-5-nitroanilino)-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(2-methyl-5-nitro-anilino)-1-(4-phenylpiperazino)ethanone Formula: C19H22N4O3 MolecularWeight: 354.40298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H22N4O3/c1-15-7-8-17(23(25)26)13-18(15)20-14-19(24)22-11-9-21(10-12-22)16-5-3-2-4-6-16/h2-8,13,20H,9-12,14H2,1H3