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

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

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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(10-8-17-4-1-2-5-17)22-12-14-23(15-13-22)21(26)11-9-18-6-3-7-19(16-18)24(27)28/h3,6-7,9,11,16-17H,1-2,4-5,8,10,12-15H2/b11-9+