2-naphthalen-1-yl-1-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]piperazin-1-yl]ethanone

Systemtic Name: 2-naphthalen-1-yl-1-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[3-(benzylamino)-4-nitro-phenyl]piperazin-1-yl]-2-(1-naphthyl)ethanone CAS Name: 2-(1-naphthalenyl)-1-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-2-naphthalen-1-ylethanone Traditional Name: 1-[4-[3-(benzylamino)-4-nitro-phenyl]piperazino]-2-(1-naphthyl)ethanone Formula: C29H28N4O3 MolecularWeight: 480.55762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C(=O)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C(=O)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H28N4O3/c34-29(19-24-11-6-10-23-9-4-5-12-26(23)24)32-17-15-31(16-18-32)25-13-14-28(33(35)36)27(20-25)30-21-22-7-2-1-3-8-22/h1-14,20,30H,15-19,21H2