2,2-dimethyl-1-[4-[4-nitro-3-(prop-2-enylamino)phenyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[4-[4-nitro-3-(prop-2-enylamino)phenyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[3-(allylamino)-4-nitro-phenyl]piperazin-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 2,2-dimethyl-1-[4-[4-nitro-3-(prop-2-enylamino)phenyl]-1-piperazinyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[4-[4-nitro-3-(prop-2-enylamino)phenyl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[3-(allylamino)-4-nitro-phenyl]piperazino]-2,2-dimethyl-propan-1-one Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC=C

Isomeric SMILES

CC(C)(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC=C

InChI

InChI=1S/C18H26N4O3/c1-5-8-19-15-13-14(6-7-16(15)22(24)25)20-9-11-21(12-10-20)17(23)18(2,3)4/h5-7,13,19H,1,8-12H2,2-4H3