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

Systemtic Name: 2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(2-chloro-5-nitro-benzyl)-methyl-amino]-1-(4-phenylpiperazino)ethanone Formula: C20H23ClN4O3 MolecularWeight: 402.87462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN4O3/c1-22(14-16-13-18(25(27)28)7-8-19(16)21)15-20(26)24-11-9-23(10-12-24)17-5-3-2-4-6-17/h2-8,13H,9-12,14-15H2,1H3