(E)-3-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one Openeye Name: (E)-3-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one CAS Name: (E)-3-(5-tert-butyl-2-methoxyphenyl)-1-[2-(4-methyl-1-piperazinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(5-tert-butyl-2-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one Traditional Name: (E)-3-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(4-methylpiperazino)phenyl]prop-2-en-1-one Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)C=CC(=O)C2=CC=CC=C2N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)/C=C/C(=O)C2=CC=CC=C2N3CCN(CC3)C

InChI

InChI=1S/C25H32N2O2/c1-25(2,3)20-11-13-24(29-5)19(18-20)10-12-23(28)21-8-6-7-9-22(21)27-16-14-26(4)15-17-27/h6-13,18H,14-17H2,1-5H3/b12-10+