(E)-3-(4-cyclopentylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-cyclopentylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-cyclopentylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one CAS Name: (E)-3-(4-cyclopentyl-1-piperazinyl)-1-[3-nitro-4-(1-pyrrolidinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-cyclopentylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-cyclopentylpiperazino)-1-(3-nitro-4-pyrrolidino-phenyl)prop-2-en-1-one Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCN(CC2)C=CC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N2CCN(CC2)/C=C/C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H30N4O3/c27-22(9-12-23-13-15-24(16-14-23)19-5-1-2-6-19)18-7-8-20(21(17-18)26(28)29)25-10-3-4-11-25/h7-9,12,17,19H,1-6,10-11,13-16H2/b12-9+