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

Systemtic Name: (E)-3-(4-cyclohexylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-cyclohexylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one CAS Name: (E)-3-(4-cyclohexyl-1-piperazinyl)-1-[3-nitro-4-(1-pyrrolidinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-cyclohexylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-cyclohexylpiperazino)-1-(3-nitro-4-pyrrolidino-phenyl)prop-2-en-1-one Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C=CC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)/C=C/C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H32N4O3/c28-23(10-13-24-14-16-25(17-15-24)20-6-2-1-3-7-20)19-8-9-21(22(18-19)27(29)30)26-11-4-5-12-26/h8-10,13,18,20H,1-7,11-12,14-17H2/b13-10+