(E)-1-(4-cyclohexylphenyl)-3-(3-nitro-4-piperidin-1-yl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-cyclohexylphenyl)-3-(3-nitro-4-piperidin-1-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-cyclohexylphenyl)-3-[3-nitro-4-(1-piperidyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-cyclohexylphenyl)-3-[3-nitro-4-(1-piperidinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-cyclohexylphenyl)-3-(3-nitro-4-piperidin-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-cyclohexylphenyl)-3-(3-nitro-4-piperidino-phenyl)prop-2-en-1-one Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)C=CC3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)/C=C/C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C26H30N2O3/c29-26(23-13-11-22(12-14-23)21-7-3-1-4-8-21)16-10-20-9-15-24(25(19-20)28(30)31)27-17-5-2-6-18-27/h9-16,19,21H,1-8,17-18H2/b16-10+