1-[2,3,6-trimethyl-4-[(E)-3-(4-nitrophenyl)prop-2-enyl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-[2,3,6-trimethyl-4-[(E)-3-(4-nitrophenyl)prop-2-enyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[2,3,6-trimethyl-4-[(E)-3-(4-nitrophenyl)allyl]piperazin-1-yl]propan-1-one CAS Name: 1-[2,3,6-trimethyl-4-[(E)-3-(4-nitrophenyl)prop-2-enyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[2,3,6-trimethyl-4-[(E)-3-(4-nitrophenyl)prop-2-enyl]piperazin-1-yl]propan-1-one Traditional Name: 1-[2,3,6-trimethyl-4-[(E)-3-(4-nitrophenyl)allyl]piperazino]propan-1-one Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CN(C(C1C)C)CC=CC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC(=O)N1C(CN(C(C1C)C)C/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H27N3O3/c1-5-19(23)21-14(2)13-20(15(3)16(21)4)12-6-7-17-8-10-18(11-9-17)22(24)25/h6-11,14-16H,5,12-13H2,1-4H3/b7-6+