7-nitro-2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: 7-nitro-2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 7-nitro-2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]tetralin-1-one CAS Name: 7-nitro-2-[4-[2-(4-nitrophenyl)ethyl]-1-piperazinyl]-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 7-nitro-2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-3,4-dihydro-2H-naphthalen-1-one Traditional Name: 7-nitro-2-[4-[2-(4-nitrophenyl)ethyl]piperazino]tetralin-1-one Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C1N3CCN(CC3)CCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C1N3CCN(CC3)CCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c27-22-20-15-19(26(30)31)7-3-17(20)4-8-21(22)24-13-11-23(12-14-24)10-9-16-1-5-18(6-2-16)25(28)29/h1-3,5-7,15,21H,4,8-14H2