3-cyclopentyl-1-[4-[(E)-3-(2-nitrophenyl)prop-2-enoyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-[(E)-3-(2-nitrophenyl)prop-2-enoyl]piperazin-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[(E)-3-(2-nitrophenyl)prop-2-enoyl]piperazin-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-[(E)-3-(2-nitrophenyl)prop-2-enoyl]piperazin-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-[(E)-3-(2-nitrophenyl)acryloyl]piperazino]propan-1-one Formula: C21H27N3O4 MolecularWeight: 385.45678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCN(CC2)C(=O)C=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O4/c25-20(11-9-17-5-1-2-6-17)22-13-15-23(16-14-22)21(26)12-10-18-7-3-4-8-19(18)24(27)28/h3-4,7-8,10,12,17H,1-2,5-6,9,11,13-16H2/b12-10+