2-(4-chloranyl-2-nitro-phenoxy)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(4-chloranyl-2-nitro-phenoxy)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(4-chloro-2-nitro-phenoxy)acetamide CAS Name: 2-(4-chloro-2-nitrophenoxy)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(4-chloro-2-nitrophenoxy)acetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-(4-chloro-2-nitro-phenoxy)acetamide Formula: C25H25ClN4O4 MolecularWeight: 480.9434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)COC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)COC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H25ClN4O4/c26-20-6-11-24(23(16-20)30(32)33)34-18-25(31)27-21-7-9-22(10-8-21)29-14-12-28(13-15-29)17-19-4-2-1-3-5-19/h1-11,16H,12-15,17-18H2,(H,27,31)